N-butyl-4-(diphenylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-butyl-4-(diphenylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: 4-benzhydryl-N-butyl-piperazin-4-ium-1-carboxamide CAS Name: N-butyl-4-(diphenylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: 4-benzhydryl-N-butylpiperazin-4-ium-1-carboxamide Traditional Name: 4-benzhydryl-N-butyl-piperazin-4-ium-1-carboxamide Formula: C22H30N3O+ MolecularWeight: 352.4931

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCCCNC(=O)N1CC[NH+](CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H29N3O/c1-2-3-14-23-22(26)25-17-15-24(16-18-25)21(19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,21H,2-3,14-18H2,1H3,(H,23,26)/p+1