O2-ethyl O4-methyl 5-[2-(3-aminophenyl)carbonyloxypropanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: O2-ethyl O4-methyl 5-[2-(3-aminophenyl)carbonyloxypropanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: O2-ethyl O4-methyl 5-[2-(3-aminobenzoyl)oxypropanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[2-[(3-aminophenyl)-oxomethoxy]-1-oxopropyl]amino]-3-methylthiophene-2,4-dicarboxylic acid O2-ethyl ester O4-methyl ester IUPAC Name: 2-O-ethyl 4-O-methyl 5-[2-(3-aminobenzoyl)oxypropanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[2-(3-aminobenzoyl)oxypropanoylamino]-3-methyl-thiophene-2,4-dicarboxylic acid O2-ethyl ester O4-methyl ester Formula: C20H22N2O7S MolecularWeight: 434.46288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(C)OC(=O)C2=CC(=CC=C2)N)C(=O)OC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C(C)OC(=O)C2=CC(=CC=C2)N)C(=O)OC)C

InChI

InChI=1S/C20H22N2O7S/c1-5-28-20(26)15-10(2)14(19(25)27-4)17(30-15)22-16(23)11(3)29-18(24)12-7-6-8-13(21)9-12/h6-9,11H,5,21H2,1-4H3,(H,22,23)