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5-methoxycarbonyl-6-[(E)-2-thiophen-3-ylethenyl]-1,4-dihydropyridine-3-carboxylic acid

5-methoxycarbonyl-6-[(E)-2-thiophen-3-ylethenyl]-1,4-dihydropyridine-3-carboxylic acid

Systemtic Name:5-methoxycarbonyl-6-[(E)-2-thiophen-3-ylethenyl]-1,4-dihydropyridine-3-carboxylic acid
Openeye Name:5-methoxycarbonyl-6-[(E)-2-(3-thienyl)vinyl]-1,4-dihydropyridine-3-carboxylic acid
CAS Name:5-methoxycarbonyl-6-[(E)-2-(3-thiophenyl)ethenyl]-1,4-dihydropyridine-3-carboxylic acid
IUPAC Name:5-methoxycarbonyl-6-[(E)-2-thiophen-3-ylethenyl]-1,4-dihydropyridine-3-carboxylic acid
Traditional Name:5-carbomethoxy-6-[(E)-2-(3-thienyl)vinyl]-1,4-dihydropyridine-3-carboxylic acid
Formula: C14H13NO4S
MolecularWeight: 291.32232
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC=C(C1)C(=O)O)C=CC2=CSC=C2


Isomeric SMILES

COC(=O)C1=C(NC=C(C1)C(=O)O)/C=C/C2=CSC=C2


InChI

InChI=1S/C14H13NO4S/c1-19-14(18)11-6-10(13(16)17)7-15-12(11)3-2-9-4-5-20-8-9/h2-5,7-8,15H,6H2,1H3,(H,16,17)/b3-2+


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