3,6-dimethyl-4-(thiophen-2-ylmethyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid

Systemtic Name: 3,6-dimethyl-4-(thiophen-2-ylmethyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid Openeye Name: 3,6-dimethyl-4-(2-thienylmethyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid CAS Name: 3,6-dimethyl-4-(thiophen-2-ylmethyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid IUPAC Name: 3,6-dimethyl-4-(thiophen-2-ylmethyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid Traditional Name: 3,6-dimethyl-4-(2-thenyl)-2,4-dihydro-1H-pyridine-3,5-dicarboxylic acid Formula: C14H17NO4S MolecularWeight: 295.35408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(CN1)(C)C(=O)O)CC2=CC=CS2)C(=O)O

Isomeric SMILES

CC1=C(C(C(CN1)(C)C(=O)O)CC2=CC=CS2)C(=O)O

InChI

InChI=1S/C14H17NO4S/c1-8-11(12(16)17)10(6-9-4-3-5-20-9)14(2,7-15-8)13(18)19/h3-5,10,15H,6-7H2,1-2H3,(H,16,17)(H,18,19)