1-dimethoxyphosphoryl-5-[(E)-2-phenylethenyl]-2-(phenylmethyl)-1,3-dihydro-2-benzazepine

Systemtic Name: 1-dimethoxyphosphoryl-5-[(E)-2-phenylethenyl]-2-(phenylmethyl)-1,3-dihydro-2-benzazepine Openeye Name: 2-benzyl-1-dimethoxyphosphoryl-5-[(E)-styryl]-1,3-dihydro-2-benzazepine CAS Name: 1-dimethoxyphosphoryl-5-[(E)-2-phenylethenyl]-2-(phenylmethyl)-1,3-dihydro-2-benzazepine IUPAC Name: 2-benzyl-1-dimethoxyphosphoryl-5-[(E)-2-phenylethenyl]-1,3-dihydro-2-benzazepine Traditional Name: 2-benzyl-1-dimethoxyphosphoryl-5-[(E)-styryl]-1,3-dihydro-2-benzazepine Formula: C27H28NO3P MolecularWeight: 445.489881

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C1C2=CC=CC=C2C(=CCN1CC3=CC=CC=C3)C=CC4=CC=CC=C4)OC

Isomeric SMILES

COP(=O)(C1C2=CC=CC=C2C(=CCN1CC3=CC=CC=C3)/C=C/C4=CC=CC=C4)OC

InChI

InChI=1S/C27H28NO3P/c1-30-32(29,31-2)27-26-16-10-9-15-25(26)24(18-17-22-11-5-3-6-12-22)19-20-28(27)21-23-13-7-4-8-14-23/h3-19,27H,20-21H2,1-2H3/b18-17+