(4As,9As)-2,4A,9-Trimethyl-2,3,4,4A,9,9A-Hexahydro[1,2]Oxazino[6,5-B]Indol-6-Yl (2-Ethylphenyl)Carbamate

Molecule SVG Image

Properties Simple | Detailed

Formula C22H28N3O3+
IUPAC Name [(2s,4as,9r,9as)-2,4a,9-trimethyl-4,9a-dihydro-3h-oxazino[6,5-b]indol-6-yl] n-(2-ethylphenyl)carbamate
Molecular Mass 382.476 g·mol−1
Heat of Formation -253.8 ± 16.7 kJ·mol−1
Dipole Moment 1.46 ± 1.08 D
Volume 464.55 Å 3
Surface Area 401.8 Å 2
HOMO Energy -8.33 ± 0.55 eV
LUMO Energy 3.12 ± eV
Point Group Symmetry C1
Synonyms
  • [(4as,9as)-2,4a,9-trimethyl-4,9a-dihydro-3h-[1,2]oxazino[6,5-b]indol-6-yl] n-(2-ethylphenyl)carbamate
  • n-(2-ethylphenyl)carbamic acid [(4as,9as)-2,4a,9-trimethyl-4,9a-dihydro-3h-oxazino[6,5-b]indol-6-yl] ester
InChIKey ZOBDWFRKFSPCRB-UNMCSNQZSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N