2-[4-(diphenylmethyl)piperazin-1-ium-1-yl]-N-(2-methylquinolin-4-yl)ethanamide

Systemtic Name: 2-[4-(diphenylmethyl)piperazin-1-ium-1-yl]-N-(2-methylquinolin-4-yl)ethanamide Openeye Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-(2-methyl-4-quinolyl)acetamide CAS Name: 2-[4-(diphenylmethyl)-1-piperazin-1-iumyl]-N-(2-methyl-4-quinolinyl)acetamide IUPAC Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-(2-methylquinolin-4-yl)acetamide Traditional Name: 2-(4-benzhydrylpiperazin-1-ium-1-yl)-N-(2-methyl-4-quinolyl)acetamide Formula: C29H31N4O+ MolecularWeight: 451.58264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C[NH+]3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=C1)NC(=O)C[NH+]3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H30N4O/c1-22-20-27(25-14-8-9-15-26(25)30-22)31-28(34)21-32-16-18-33(19-17-32)29(23-10-4-2-5-11-23)24-12-6-3-7-13-24/h2-15,20,29H,16-19,21H2,1H3,(H,30,31,34)/p+1