6-but-3-en-1-ynyl-4-(2,6,6-trimethylcyclohexen-1-yl)pyridine-3-carbaldehyde

Systemtic Name: 6-but-3-en-1-ynyl-4-(2,6,6-trimethylcyclohexen-1-yl)pyridine-3-carbaldehyde Openeye Name: 6-but-3-en-1-ynyl-4-(2,6,6-trimethylcyclohexen-1-yl)pyridine-3-carbaldehyde CAS Name: 6-but-3-en-1-ynyl-4-(2,6,6-trimethyl-1-cyclohexenyl)-3-pyridinecarboxaldehyde IUPAC Name: 6-but-3-en-1-ynyl-4-(2,6,6-trimethylcyclohexen-1-yl)pyridine-3-carbaldehyde Traditional Name: 6-but-3-en-1-ynyl-4-(2,6,6-trimethylcyclohexen-1-yl)nicotinaldehyde Formula: C19H21NO MolecularWeight: 279.37614

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO/c1-5-6-9-16-11-17(15(13-21)12-20-16)18-14(2)8-7-10-19(18,3)4/h5,11-13H,1,7-8,10H2,2-4H3