1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-6-phenylmethoxy-4-(quinolin-6-ylmethyl)-1,4-diazepan-2-one

Systemtic Name: 1-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]-6-phenylmethoxy-4-(quinolin-6-ylmethyl)-1,4-diazepan-2-one Openeye Name: 6-benzyloxy-1-[3-(2-oxopyrrolidin-1-yl)propyl]-4-(6-quinolylmethyl)-1,4-diazepan-2-one CAS Name: 1-[3-(2-oxo-1-pyrrolidinyl)propyl]-6-phenylmethoxy-4-(6-quinolinylmethyl)-1,4-diazepan-2-one IUPAC Name: 1-[3-(2-oxopyrrolidin-1-yl)propyl]-6-phenylmethoxy-4-(quinolin-6-ylmethyl)-1,4-diazepan-2-one Traditional Name: 6-benzoxy-1-[3-(2-ketopyrrolidino)propyl]-4-(6-quinolylmethyl)-1,4-diazepan-2-one Formula: C29H34N4O3 MolecularWeight: 486.60526

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCN2CC(CN(CC2=O)CC3=CC4=C(C=C3)N=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CC(=O)N(C1)CCCN2CC(CN(CC2=O)CC3=CC4=C(C=C3)N=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H34N4O3/c34-28-10-5-14-32(28)15-6-16-33-20-26(36-22-23-7-2-1-3-8-23)19-31(21-29(33)35)18-24-11-12-27-25(17-24)9-4-13-30-27/h1-4,7-9,11-13,17,26H,5-6,10,14-16,18-22H2