4-hept-1-ynyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-hept-1-ynyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-hept-1-ynyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-hept-1-ynyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-hept-1-ynyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-hept-1-ynyl-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C16H21NO4 MolecularWeight: 291.34224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC#CC1C(=C(NC(=C1C(=O)O)C)C)C(=O)O

Isomeric SMILES

CCCCCC#CC1C(=C(NC(=C1C(=O)O)C)C)C(=O)O

InChI

InChI=1S/C16H21NO4/c1-4-5-6-7-8-9-12-13(15(18)19)10(2)17-11(3)14(12)16(20)21/h12,17H,4-7H2,1-3H3,(H,18,19)(H,20,21)