propyl 2-phenyl-2-[4-[4-[(2-phenylphenyl)carbonylamino]phenyl]-1,4-diazepan-1-yl]ethanoate

Systemtic Name: propyl 2-phenyl-2-[4-[4-[(2-phenylphenyl)carbonylamino]phenyl]-1,4-diazepan-1-yl]ethanoate Openeye Name: propyl 2-phenyl-2-[4-[4-[(2-phenylbenzoyl)amino]phenyl]-1,4-diazepan-1-yl]acetate CAS Name: 2-[4-[4-[[oxo-(2-phenylphenyl)methyl]amino]phenyl]-1,4-diazepan-1-yl]-2-phenylacetic acid propyl ester IUPAC Name: propyl 2-phenyl-2-[4-[4-[(2-phenylbenzoyl)amino]phenyl]-1,4-diazepan-1-yl]acetate Traditional Name: 2-phenyl-2-[4-[4-[(2-phenylbenzoyl)amino]phenyl]-1,4-diazepan-1-yl]acetic acid propyl ester Formula: C35H37N3O3 MolecularWeight: 547.68658

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C(C1=CC=CC=C1)N2CCCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

CCCOC(=O)C(C1=CC=CC=C1)N2CCCN(CC2)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C35H37N3O3/c1-2-26-41-35(40)33(28-14-7-4-8-15-28)38-23-11-22-37(24-25-38)30-20-18-29(19-21-30)36-34(39)32-17-10-9-16-31(32)27-12-5-3-6-13-27/h3-10,12-21,33H,2,11,22-26H2,1H3,(H,36,39)