2-methyl-4-(3-nitrophenyl)-6-thiophen-2-yl-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: 2-methyl-4-(3-nitrophenyl)-6-thiophen-2-yl-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: 2-methyl-4-(3-nitrophenyl)-6-(2-thienyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-methyl-4-(3-nitrophenyl)-6-thiophen-2-yl-1,4-dihydropyridine-3,5-dicarboxylate IUPAC Name: 2-methyl-4-(3-nitrophenyl)-6-thiophen-2-yl-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-methyl-4-(3-nitrophenyl)-6-(2-thienyl)-1,4-dihydropyridine-3,5-dicarboxylate Formula: C18H12N2O6S-2 MolecularWeight: 384.36268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C2=CC=CS2)C(=O)[O-])C3=CC(=CC=C3)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CC1=C(C(C(=C(N1)C2=CC=CS2)C(=O)[O-])C3=CC(=CC=C3)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C18H14N2O6S/c1-9-13(17(21)22)14(10-4-2-5-11(8-10)20(25)26)15(18(23)24)16(19-9)12-6-3-7-27-12/h2-8,14,19H,1H3,(H,21,22)(H,23,24)/p-2