N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-4-piperidin-1-yl-benzamide

Systemtic Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[4-(4-methyl-1-piperazin-4-iumyl)phenyl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[4-(4-methylpiperazin-4-ium-1-yl)phenyl]-3-nitro-4-piperidino-benzamide Formula: C23H30N5O3+ MolecularWeight: 424.516

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

Isomeric SMILES

C[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC(=C(C=C3)N4CCCCC4)[N+](=O)[O-]

InChI

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