(phenylmethyl) (4S)-4-ethoxy-4-phenyl-3,7-dihydro-2H-azepine-1-carboxylate

Systemtic Name: (phenylmethyl) (4S)-4-ethoxy-4-phenyl-3,7-dihydro-2H-azepine-1-carboxylate Openeye Name: benzyl (4S)-4-ethoxy-4-phenyl-3,7-dihydro-2H-azepine-1-carboxylate CAS Name: (4S)-4-ethoxy-4-phenyl-3,7-dihydro-2H-azepine-1-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl (4S)-4-ethoxy-4-phenyl-3,7-dihydro-2H-azepine-1-carboxylate Traditional Name: (4S)-4-ethoxy-4-phenyl-3,7-dihydro-2H-azepine-1-carboxylic acid benzyl ester Formula: C22H25NO3 MolecularWeight: 351.4388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1(CCN(CC=C1)C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCO[C@]1(CCN(CC=C1)C(=O)OCC2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H25NO3/c1-2-26-22(20-12-7-4-8-13-20)14-9-16-23(17-15-22)21(24)25-18-19-10-5-3-6-11-19/h3-14H,2,15-18H2,1H3/t22-/m1/s1