1-cyclohexyl-5-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-N-methyl-4-oxidanylidene-pyridine-3-carboxamide

Systemtic Name: 1-cyclohexyl-5-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-N-methyl-4-oxidanylidene-pyridine-3-carboxamide Openeye Name: 1-cyclohexyl-5-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]-N-methyl-4-oxo-pyridine-3-carboxamide CAS Name: 1-cyclohexyl-5-[[4-[(3-methoxyphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-N-methyl-4-oxo-3-pyridinecarboxamide IUPAC Name: 1-cyclohexyl-5-[4-[(3-methoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]-N-methyl-4-oxopyridine-3-carboxamide Traditional Name: 1-cyclohexyl-4-keto-5-(4-m-anisylpiperazin-4-ium-1-carbonyl)-N-methyl-nicotinamide Formula: C26H35N4O4+ MolecularWeight: 467.5805

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CN(C=C(C1=O)C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)OC)C4CCCCC4

Isomeric SMILES

CNC(=O)C1=CN(C=C(C1=O)C(=O)N2CC[NH+](CC2)CC3=CC(=CC=C3)OC)C4CCCCC4

InChI

InChI=1S/C26H34N4O4/c1-27-25(32)22-17-30(20-8-4-3-5-9-20)18-23(24(22)31)26(33)29-13-11-28(12-14-29)16-19-7-6-10-21(15-19)34-2/h6-7,10,15,17-18,20H,3-5,8-9,11-14,16H2,1-2H3,(H,27,32)/p+1