1-[2-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxidanylidene-ethyl]-3-propyl-benzimidazol-2-one

Systemtic Name: 1-[2-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxidanylidene-ethyl]-3-propyl-benzimidazol-2-one Openeye Name: 1-[2-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxo-ethyl]-3-propyl-benzimidazol-2-one CAS Name: 1-[2-[2-(1-methyl-2-pyrrolyl)-1-azepanyl]-2-oxoethyl]-3-propyl-2-benzimidazolone IUPAC Name: 1-[2-[2-(1-methylpyrrol-2-yl)azepan-1-yl]-2-oxoethyl]-3-propylbenzimidazol-2-one Traditional Name: 1-[2-keto-2-[2-(1-methylpyrrol-2-yl)azepan-1-yl]ethyl]-3-propyl-benzimidazol-2-one Formula: C23H30N4O2 MolecularWeight: 394.5099

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)CC(=O)N3CCCCCC3C4=CC=CN4C

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)CC(=O)N3CCCCCC3C4=CC=CN4C

InChI

InChI=1S/C23H30N4O2/c1-3-14-26-20-11-6-7-12-21(20)27(23(26)29)17-22(28)25-16-8-4-5-10-19(25)18-13-9-15-24(18)2/h6-7,9,11-13,15,19H,3-5,8,10,14,16-17H2,1-2H3