[1-(2-nitrophenyl)piperidin-4-yl]-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [1-(2-nitrophenyl)piperidin-4-yl]-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-[1-(2-nitrophenyl)-4-piperidyl]methanone CAS Name: [1-(2-nitrophenyl)-4-piperidinyl]-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-[1-(2-nitrophenyl)piperidin-4-yl]methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-[1-(2-nitrophenyl)-4-piperidyl]methanone Formula: C23H29N4O3+ MolecularWeight: 409.50136

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1C(=O)N2CC[NH+](CC2)CC3=CC=CC=C3)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C23H28N4O3/c28-23(26-16-14-24(15-17-26)18-19-6-2-1-3-7-19)20-10-12-25(13-11-20)21-8-4-5-9-22(21)27(29)30/h1-9,20H,10-18H2/p+1