2-phenyl-1-[6-(phenylazanylmethyl)-4-(2-phenylethanoyl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2-phenyl-1-[6-(phenylazanylmethyl)-4-(2-phenylethanoyl)-1,4-diazepan-1-yl]ethanone Openeye Name: 1-[6-(anilinomethyl)-4-(2-phenylacetyl)-1,4-diazepan-1-yl]-2-phenyl-ethanone CAS Name: 1-[6-(anilinomethyl)-4-(1-oxo-2-phenylethyl)-1,4-diazepan-1-yl]-2-phenylethanone IUPAC Name: 1-[6-(anilinomethyl)-4-(2-phenylacetyl)-1,4-diazepan-1-yl]-2-phenylethanone Traditional Name: 1-[6-(anilinomethyl)-4-(2-phenylacetyl)-1,4-diazepan-1-yl]-2-phenyl-ethanone Formula: C28H31N3O2 MolecularWeight: 441.56464

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(CN1C(=O)CC2=CC=CC=C2)CNC3=CC=CC=C3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC(CN1C(=O)CC2=CC=CC=C2)CNC3=CC=CC=C3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C28H31N3O2/c32-27(18-23-10-4-1-5-11-23)30-16-17-31(28(33)19-24-12-6-2-7-13-24)22-25(21-30)20-29-26-14-8-3-9-15-26/h1-15,25,29H,16-22H2