4-(1-benzothiophen-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid

Systemtic Name: 4-(1-benzothiophen-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Openeye Name: 4-(benzothiophen-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid CAS Name: 4-(1-benzothiophen-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid IUPAC Name: 4-(1-benzothiophen-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Traditional Name: 4-(benzothiophen-4-yl)-2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylic acid Formula: C17H15NO4S MolecularWeight: 329.3703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)O)C2=C3C=CSC3=CC=C2)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)O)C2=C3C=CSC3=CC=C2)C(=O)O

InChI

InChI=1S/C17H15NO4S/c1-8-13(16(19)20)15(14(17(21)22)9(2)18-8)11-4-3-5-12-10(11)6-7-23-12/h3-7,15,18H,1-2H3,(H,19,20)(H,21,22)