1-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-3-propyl-benzimidazol-2-one

Systemtic Name: 1-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-3-propyl-benzimidazol-2-one Openeye Name: 1-[[4-(6-nitro-3-pyridyl)piperazin-1-yl]methyl]-3-propyl-benzimidazol-2-one CAS Name: 1-[[4-(6-nitro-3-pyridinyl)-1-piperazinyl]methyl]-3-propyl-2-benzimidazolone IUPAC Name: 1-[[4-(6-nitropyridin-3-yl)piperazin-1-yl]methyl]-3-propylbenzimidazol-2-one Traditional Name: 1-[[4-(6-nitro-3-pyridyl)piperazino]methyl]-3-propyl-benzimidazol-2-one Formula: C20H24N6O3 MolecularWeight: 396.44296

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=CC=CC=C2N(C1=O)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=CC=CC=C2N(C1=O)CN3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H24N6O3/c1-2-9-24-17-5-3-4-6-18(17)25(20(24)27)15-22-10-12-23(13-11-22)16-7-8-19(21-14-16)26(28)29/h3-8,14H,2,9-13,15H2,1H3