4-(diphenylmethyl)-N-(1-oxidanidylquinolin-1-ium-3-yl)piperazine-1-carboxamide

Systemtic Name: 4-(diphenylmethyl)-N-(1-oxidanidylquinolin-1-ium-3-yl)piperazine-1-carboxamide Openeye Name: 4-benzhydryl-N-(1-oxidoquinolin-1-ium-3-yl)piperazine-1-carboxamide CAS Name: 4-(diphenylmethyl)-N-(1-oxido-3-quinolin-1-iumyl)-1-piperazinecarboxamide IUPAC Name: 4-benzhydryl-N-(1-oxidoquinolin-1-ium-3-yl)piperazine-1-carboxamide Traditional Name: 4-benzhydryl-N-(1-oxidoquinolin-1-ium-3-yl)piperazine-1-carboxamide Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC5=CC=CC=C5[N+](=C4)[O-]

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC5=CC=CC=C5[N+](=C4)[O-]

InChI

InChI=1S/C27H26N4O2/c32-27(28-24-19-23-13-7-8-14-25(23)31(33)20-24)30-17-15-29(16-18-30)26(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-14,19-20,26H,15-18H2,(H,28,32)