(1Z)-4-butyl-N-pyridin-1-ium-1-yl-benzenecarboximidate

Systemtic Name: (1Z)-4-butyl-N-pyridin-1-ium-1-yl-benzenecarboximidate Openeye Name: (1Z)-4-butyl-N-pyridin-1-ium-1-yl-benzenecarboximidate CAS Name: (1Z)-4-butyl-N-(1-pyridin-1-iumyl)benzenecarboximidate IUPAC Name: (1Z)-4-butyl-N-pyridin-1-ium-1-ylbenzenecarboximidate Traditional Name: (1Z)-4-butyl-N-pyridin-1-ium-1-yl-benzenecarboximidate Formula: C16H18N2O MolecularWeight: 254.32692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=N[N+]2=CC=CC=C2)[O-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)/C(=N/[N+]2=CC=CC=C2)/[O-]

InChI

InChI=1S/C16H18N2O/c1-2-3-7-14-8-10-15(11-9-14)16(19)17-18-12-5-4-6-13-18/h4-6,8-13H,2-3,7H2,1H3