ethyl (3S)-7-phenyl-3-(phenylmethyl)-2,3-dihydro-1,4-oxazepine-5-carboxylate

Systemtic Name: ethyl (3S)-7-phenyl-3-(phenylmethyl)-2,3-dihydro-1,4-oxazepine-5-carboxylate Openeye Name: ethyl (3S)-3-benzyl-7-phenyl-2,3-dihydro-1,4-oxazepine-5-carboxylate CAS Name: (3S)-7-phenyl-3-(phenylmethyl)-2,3-dihydro-1,4-oxazepine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (3S)-3-benzyl-7-phenyl-2,3-dihydro-1,4-oxazepine-5-carboxylate Traditional Name: (3S)-3-benzyl-7-phenyl-2,3-dihydro-1,4-oxazepine-5-carboxylic acid ethyl ester Formula: C21H21NO3 MolecularWeight: 335.39634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(COC(=C1)C2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=N[C@H](COC(=C1)C2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C21H21NO3/c1-2-24-21(23)19-14-20(17-11-7-4-8-12-17)25-15-18(22-19)13-16-9-5-3-6-10-16/h3-12,14,18H,2,13,15H2,1H3/t18-/m0/s1