propan-2-yl 2,6-dimethyl-5-nitro-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: propan-2-yl 2,6-dimethyl-5-nitro-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: isopropyl 2,6-dimethyl-5-nitro-4-(3-thienyl)-1,4-dihydropyridine-3-carboxylate CAS Name: 2,6-dimethyl-5-nitro-4-(3-thiophenyl)-1,4-dihydropyridine-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,6-dimethyl-5-nitro-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: 2,6-dimethyl-5-nitro-4-(3-thienyl)-1,4-dihydropyridine-3-carboxylic acid isopropyl ester Formula: C15H18N2O4S MolecularWeight: 322.37942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CSC=C2)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(C(=C(N1)C)[N+](=O)[O-])C2=CSC=C2)C(=O)OC(C)C

InChI

InChI=1S/C15H18N2O4S/c1-8(2)21-15(18)12-9(3)16-10(4)14(17(19)20)13(12)11-5-6-22-7-11/h5-8,13,16H,1-4H3