N-(2-cyanophenyl)-4-(diphenylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-(2-cyanophenyl)-4-(diphenylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-benzhydryl-N-(2-cyanophenyl)piperazin-4-ium-1-carboxamide CAS Name: N-(2-cyanophenyl)-4-(diphenylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-benzhydryl-N-(2-cyanophenyl)piperazin-4-ium-1-carboxamide Traditional Name: 4-benzhydryl-N-(2-cyanophenyl)piperazin-4-ium-1-carboxamide Formula: C25H25N4O+ MolecularWeight: 397.4922

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4C#N

InChI

InChI=1S/C25H24N4O/c26-19-22-13-7-8-14-23(22)27-25(30)29-17-15-28(16-18-29)24(20-9-3-1-4-10-20)21-11-5-2-6-12-21/h1-14,24H,15-18H2,(H,27,30)/p+1