[3-(4-methyl-3,5,5a,6,7,8,9,9a-octahydro-2H-benzo[f][1,4]oxazepin-9-yl)phenyl] ethanoate

Systemtic Name: [3-(4-methyl-3,5,5a,6,7,8,9,9a-octahydro-2H-benzo[f][1,4]oxazepin-9-yl)phenyl] ethanoate Openeye Name: [3-(4-methyl-3,5,5a,6,7,8,9,9a-octahydro-2H-benzo[f][1,4]oxazepin-9-yl)phenyl] acetate CAS Name: acetic acid [3-(4-methyl-3,5,5a,6,7,8,9,9a-octahydro-2H-benzo[f][1,4]oxazepin-9-yl)phenyl] ester IUPAC Name: [3-(4-methyl-3,5,5a,6,7,8,9,9a-octahydro-2H-benzo[f][1,4]oxazepin-9-yl)phenyl] acetate Traditional Name: acetic acid [3-(4-methyl-3,5,5a,6,7,8,9,9a-octahydro-2H-benzo[f][1,4]oxazepin-9-yl)phenyl] ester Formula: C18H25NO3 MolecularWeight: 303.396

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC(=C1)C2CCCC3C2OCCN(C3)C

Isomeric SMILES

CC(=O)OC1=CC=CC(=C1)C2CCCC3C2OCCN(C3)C

InChI

InChI=1S/C18H25NO3/c1-13(20)22-16-7-3-5-14(11-16)17-8-4-6-15-12-19(2)9-10-21-18(15)17/h3,5,7,11,15,17-18H,4,6,8-10,12H2,1-2H3