N-[3-(2-oxidanylideneazepan-1-yl)propyl]-4-pyrrol-1-yl-benzamide

Systemtic Name: N-[3-(2-oxidanylideneazepan-1-yl)propyl]-4-pyrrol-1-yl-benzamide Openeye Name: N-[3-(2-oxoazepan-1-yl)propyl]-4-pyrrol-1-yl-benzamide CAS Name: N-[3-(2-oxo-1-azepanyl)propyl]-4-(1-pyrrolyl)benzamide IUPAC Name: N-[3-(2-oxoazepan-1-yl)propyl]-4-pyrrol-1-ylbenzamide Traditional Name: N-[3-(2-ketoazepan-1-yl)propyl]-4-pyrrol-1-yl-benzamide Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC=C(C=C2)N3C=CC=C3

Isomeric SMILES

C1CCC(=O)N(CC1)CCCNC(=O)C2=CC=C(C=C2)N3C=CC=C3

InChI

InChI=1S/C20H25N3O2/c24-19-7-2-1-3-15-23(19)16-6-12-21-20(25)17-8-10-18(11-9-17)22-13-4-5-14-22/h4-5,8-11,13-14H,1-3,6-7,12,15-16H2,(H,21,25)