dimethyl 5-azanyl-3-[[4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoyl]oxymethyl]thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 5-azanyl-3-[[4-(5-chloranylthiophen-2-yl)-4-oxidanylidene-butanoyl]oxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[[4-(5-chloro-2-thienyl)-4-oxo-butanoyl]oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[[4-(5-chloro-2-thiophenyl)-1,4-dioxobutoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[[4-(5-chlorothiophen-2-yl)-4-oxobutanoyl]oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[[4-(5-chloro-2-thienyl)-4-keto-butanoyl]oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C17H16ClNO7S2 MolecularWeight: 445.89444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1COC(=O)CCC(=O)C2=CC=C(S2)Cl)C(=O)OC)N

Isomeric SMILES

COC(=O)C1=C(SC(=C1COC(=O)CCC(=O)C2=CC=C(S2)Cl)C(=O)OC)N

InChI

InChI=1S/C17H16ClNO7S2/c1-24-16(22)13-8(14(17(23)25-2)28-15(13)19)7-26-12(21)6-3-9(20)10-4-5-11(18)27-10/h4-5H,3,6-7,19H2,1-2H3