6,8-bis(methoxycarbonyl)-5,8a-dimethyl-7-(3-nitrophenyl)-2,3,7,8-tetrahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid

Systemtic Name: 6,8-bis(methoxycarbonyl)-5,8a-dimethyl-7-(3-nitrophenyl)-2,3,7,8-tetrahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid Openeye Name: 6,8-bis(methoxycarbonyl)-5,8a-dimethyl-7-(3-nitrophenyl)-2,3,7,8-tetrahydrothiazolo[3,2-a]pyridine-3-carboxylic acid CAS Name: 6,8-bis(methoxycarbonyl)-5,8a-dimethyl-7-(3-nitrophenyl)-2,3,7,8-tetrahydrothiazolo[3,2-a]pyridine-3-carboxylic acid IUPAC Name: 6,8-bis(methoxycarbonyl)-5,8a-dimethyl-7-(3-nitrophenyl)-2,3,7,8-tetrahydro-[1,3]thiazolo[3,2-a]pyridine-3-carboxylic acid Traditional Name: 6,8-dicarbomethoxy-5,8a-dimethyl-7-(3-nitrophenyl)-2,3,7,8-tetrahydrothiazolo[3,2-a]pyridine-3-carboxylic acid Formula: C20H22N2O8S MolecularWeight: 450.46228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(C2(N1C(CS2)C(=O)O)C)C(=O)OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CC1=C(C(C(C2(N1C(CS2)C(=O)O)C)C(=O)OC)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C20H22N2O8S/c1-10-14(18(25)29-3)15(11-6-5-7-12(8-11)22(27)28)16(19(26)30-4)20(2)21(10)13(9-31-20)17(23)24/h5-8,13,15-16H,9H2,1-4H3,(H,23,24)