N-[(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]pyridine-4-carboxamide

Systemtic Name: N-[(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]pyridine-4-carboxamide Openeye Name: N-[(E)-[1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)prop-2-enylidene]amino]pyridine-4-carboxamide CAS Name: N-[(E)-4-(2,6,6-trimethyl-1-cyclohexenyl)but-3-en-2-ylideneamino]-4-pyridinecarboxamide IUPAC Name: N-[(E)-4-(2,6,6-trimethylcyclohexen-1-yl)but-3-en-2-ylideneamino]pyridine-4-carboxamide Traditional Name: N-[(E)-[1-methyl-3-(2,6,6-trimethylcyclohexen-1-yl)prop-2-enylidene]amino]isonicotinamide Formula: C19H25N3O MolecularWeight: 311.4213

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC(=NNC(=O)C2=CC=NC=C2)C

Isomeric SMILES

CC1=C(C(CCC1)(C)C)C=C/C(=N/NC(=O)C2=CC=NC=C2)/C

InChI

InChI=1S/C19H25N3O/c1-14-6-5-11-19(3,4)17(14)8-7-15(2)21-22-18(23)16-9-12-20-13-10-16/h7-10,12-13H,5-6,11H2,1-4H3,(H,22,23)/b8-7?,21-15+