4-[3-(2-chlorophenyl)propanoyl]-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 4-[3-(2-chlorophenyl)propanoyl]-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-4-[3-(2-chlorophenyl)propanoyl]-1-(3-pyridylmethyl)-1,4-diazepan-2-one CAS Name: 4-[3-(2-chlorophenyl)-1-oxopropyl]-6-phenylmethoxy-1-(3-pyridinylmethyl)-1,4-diazepan-2-one IUPAC Name: 4-[3-(2-chlorophenyl)propanoyl]-6-phenylmethoxy-1-(pyridin-3-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-4-[3-(2-chlorophenyl)propanoyl]-1-(3-pyridylmethyl)-1,4-diazepan-2-one Formula: C27H28ClN3O3 MolecularWeight: 477.98252

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN(C(=O)CN1C(=O)CCC2=CC=CC=C2Cl)CC3=CN=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1C(CN(C(=O)CN1C(=O)CCC2=CC=CC=C2Cl)CC3=CN=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H28ClN3O3/c28-25-11-5-4-10-23(25)12-13-26(32)31-18-24(34-20-21-7-2-1-3-8-21)17-30(27(33)19-31)16-22-9-6-14-29-15-22/h1-11,14-15,24H,12-13,16-20H2