N-[4-(dipropylphosphorylmethyl)phenyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide

Systemtic Name: N-[4-(dipropylphosphorylmethyl)phenyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Openeye Name: N-[4-(dipropylphosphorylmethyl)phenyl]-7-(p-tolyl)-2,3-dihydro-1-benzoxepine-4-carboxamide CAS Name: N-[4-(dipropylphosphorylmethyl)phenyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepin-4-carboxamide IUPAC Name: N-[4-(dipropylphosphorylmethyl)phenyl]-7-(4-methylphenyl)-2,3-dihydro-1-benzoxepine-4-carboxamide Traditional Name: N-[4-(dipropylphosphorylmethyl)phenyl]-7-(p-tolyl)-2,3-dihydro-1-benzoxepin-4-carboxamide Formula: C31H36NO3P MolecularWeight: 501.596201

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Descriptors Computed from Structure

Canonical SMILES:

CCCP(=O)(CCC)CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3)C4=CC=C(C=C4)C)OCC2

Isomeric SMILES

CCCP(=O)(CCC)CC1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3)C4=CC=C(C=C4)C)OCC2

InChI

InChI=1S/C31H36NO3P/c1-4-18-36(34,19-5-2)22-24-8-13-29(14-9-24)32-31(33)27-16-17-35-30-15-12-26(20-28(30)21-27)25-10-6-23(3)7-11-25/h6-15,20-21H,4-5,16-19,22H2,1-3H3,(H,32,33)