4-(1,3-benzodioxol-5-yl)-5-methoxycarbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-5-methoxycarbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Openeye Name: 4-(1,3-benzodioxol-5-yl)-5-methoxycarbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid CAS Name: 4-(1,3-benzodioxol-5-yl)-5-methoxycarbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid IUPAC Name: 4-(1,3-benzodioxol-5-yl)-5-methoxycarbonyl-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Traditional Name: 4-(1,3-benzodioxol-5-yl)-5-carbomethoxy-2,6-dimethyl-1,4-dihydropyridine-3-carboxylic acid Formula: C17H17NO6 MolecularWeight: 331.31998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC3=C(C=C2)OCO3)C(=O)O

Isomeric SMILES

CC1=C(C(C(=C(N1)C)C(=O)OC)C2=CC3=C(C=C2)OCO3)C(=O)O

InChI

InChI=1S/C17H17NO6/c1-8-13(16(19)20)15(14(9(2)18-8)17(21)22-3)10-4-5-11-12(6-10)24-7-23-11/h4-6,15,18H,7H2,1-3H3,(H,19,20)