4-butoxy-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-methoxy-benzamide

Systemtic Name: 4-butoxy-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-methoxy-benzamide Openeye Name: 4-butoxy-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-methoxy-benzamide CAS Name: 4-butoxy-N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-3-methoxybenzamide IUPAC Name: 4-butoxy-N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-3-methoxybenzamide Traditional Name: 4-butoxy-N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]-3-methoxy-benzamide Formula: C24H32ClN2O3+ MolecularWeight: 431.97548

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC2CC[NH+](CC2)CC3=CC=C(C=C3)Cl)OC

InChI

InChI=1S/C24H31ClN2O3/c1-3-4-15-30-22-10-7-19(16-23(22)29-2)24(28)26-21-11-13-27(14-12-21)17-18-5-8-20(25)9-6-18/h5-10,16,21H,3-4,11-15,17H2,1-2H3,(H,26,28)/p+1