[1-(4-chlorophenyl)carbonylpiperidin-4-yl]-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [1-(4-chlorophenyl)carbonylpiperidin-4-yl]-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [1-(4-chlorobenzoyl)-4-piperidyl]-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [1-[(4-chlorophenyl)-oxomethyl]-4-piperidinyl]-[4-(pyridin-4-ylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [1-(4-chlorobenzoyl)piperidin-4-yl]-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [1-(4-chlorobenzoyl)-4-piperidyl]-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]methanone Formula: C23H28ClN4O2+ MolecularWeight: 427.94702

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CC[NH+](CC2)CC3=CC=NC=C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1C(=O)N2CC[NH+](CC2)CC3=CC=NC=C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H27ClN4O2/c24-21-3-1-19(2-4-21)22(29)27-11-7-20(8-12-27)23(30)28-15-13-26(14-16-28)17-18-5-9-25-10-6-18/h1-6,9-10,20H,7-8,11-17H2/p+1