N3,4-diphenyl-2-pyridin-1-ium-1-yl-but-1-ene-1,3-diimine

Systemtic Name: N3,4-diphenyl-2-pyridin-1-ium-1-yl-but-1-ene-1,3-diimine Openeye Name: N3,4-diphenyl-2-pyridin-1-ium-1-yl-but-1-ene-1,3-diimine CAS Name: N3,4-diphenyl-2-(1-pyridin-1-iumyl)-1-butene-1,3-diimine IUPAC Name: 3-N,4-diphenyl-2-pyridin-1-ium-1-ylbut-1-ene-1,3-diimine Traditional Name: (1-benzyl-3-imino-2-pyridin-1-ium-1-yl-prop-2-enylidene)-phenyl-amine Formula: C21H18N3+ MolecularWeight: 312.38772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=NC2=CC=CC=C2)C(=C=N)[N+]3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(=NC2=CC=CC=C2)C(=C=N)[N+]3=CC=CC=C3

InChI

InChI=1S/C21H18N3/c22-17-21(24-14-8-3-9-15-24)20(16-18-10-4-1-5-11-18)23-19-12-6-2-7-13-19/h1-15,22H,16H2/q+1