N-[4-(4-methylphenyl)piperazin-1-yl]-3-nitro-4-piperidin-1-yl-benzamide hydrochloride

Systemtic Name: N-[4-(4-methylphenyl)piperazin-1-yl]-3-nitro-4-piperidin-1-yl-benzamide hydrochloride Openeye Name: 3-nitro-4-(1-piperidyl)-N-[4-(p-tolyl)piperazin-1-yl]benzamide hydrochloride CAS Name: N-[4-(4-methylphenyl)-1-piperazinyl]-3-nitro-4-(1-piperidinyl)benzamide hydrochloride IUPAC Name: N-[4-(4-methylphenyl)piperazin-1-yl]-3-nitro-4-piperidin-1-ylbenzamide hydrochloride Traditional Name: 3-nitro-4-piperidino-N-[4-(p-tolyl)piperazino]benzamide hydrochloride Formula: C23H30ClN5O3 MolecularWeight: 459.969

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CCN(CC2)NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-].Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2CCN(CC2)NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-].Cl

InChI

InChI=1S/C23H29N5O3.ClH/c1-18-5-8-20(9-6-18)25-13-15-27(16-14-25)24-23(29)19-7-10-21(22(17-19)28(30)31)26-11-3-2-4-12-26;/h5-10,17H,2-4,11-16H2,1H3,(H,24,29);1H