N'-butyl-N'-(4,5-dihydro-1H-imidazol-2-yl)-N-phenyl-1-pyrrolidin-1-ium-1-ylidene-methanediamine

Systemtic Name: N'-butyl-N'-(4,5-dihydro-1H-imidazol-2-yl)-N-phenyl-1-pyrrolidin-1-ium-1-ylidene-methanediamine Openeye Name: N'-butyl-N'-(4,5-dihydro-1H-imidazol-2-yl)-N-phenyl-1-pyrrolidin-1-ium-1-ylidene-methanediamine CAS Name: N'-butyl-N'-(4,5-dihydro-1H-imidazol-2-yl)-N-phenyl-1-(1-pyrrolidin-1-iumylidene)methanediamine IUPAC Name: N'-butyl-N'-(4,5-dihydro-1H-imidazol-2-yl)-N-phenyl-1-pyrrolidin-1-ium-1-ylidenemethanediamine Traditional Name: [anilino(pyrrolidin-1-ium-1-ylidene)methyl]-butyl-(2-imidazolin-2-yl)amine Formula: C18H28N5+ MolecularWeight: 314.44842

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C1=NCCN1)C(=[N+]2CCCC2)NC3=CC=CC=C3

Isomeric SMILES

CCCCN(C1=NCCN1)C(=[N+]2CCCC2)NC3=CC=CC=C3

InChI

InChI=1S/C18H27N5/c1-2-3-15-23(17-19-11-12-20-17)18(22-13-7-8-14-22)21-16-9-5-4-6-10-16/h4-6,9-10H,2-3,7-8,11-15H2,1H3,(H,19,20)/p+1