2-but-3-en-1-ynyl-5-(dimethoxymethyl)-4-(2,6,6-trimethylcyclohexen-1-yl)pyridine

Systemtic Name: 2-but-3-en-1-ynyl-5-(dimethoxymethyl)-4-(2,6,6-trimethylcyclohexen-1-yl)pyridine Openeye Name: 2-but-3-en-1-ynyl-5-(dimethoxymethyl)-4-(2,6,6-trimethylcyclohexen-1-yl)pyridine CAS Name: 2-but-3-en-1-ynyl-5-(dimethoxymethyl)-4-(2,6,6-trimethyl-1-cyclohexenyl)pyridine IUPAC Name: 2-but-3-en-1-ynyl-5-(dimethoxymethyl)-4-(2,6,6-trimethylcyclohexen-1-yl)pyridine Traditional Name: 2-but-3-en-1-ynyl-5-(dimethoxymethyl)-4-(2,6,6-trimethylcyclohexen-1-yl)pyridine Formula: C21H27NO2 MolecularWeight: 325.44458

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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(OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C21H27NO2/c1-7-8-11-16-13-17(18(14-22-16)20(23-5)24-6)19-15(2)10-9-12-21(19,3)4/h7,13-14,20H,1,9-10,12H2,2-6H3