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

Systemtic Name: dimethyl 5-azanyl-3-[(4-oxidanylidene-4-phenyl-butanoyl)oxymethyl]thiophene-2,4-dicarboxylate Openeye Name: dimethyl 5-amino-3-[(4-oxo-4-phenyl-butanoyl)oxymethyl]thiophene-2,4-dicarboxylate CAS Name: 5-amino-3-[(1,4-dioxo-4-phenylbutoxy)methyl]thiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-amino-3-[(4-oxo-4-phenylbutanoyl)oxymethyl]thiophene-2,4-dicarboxylate Traditional Name: 5-amino-3-[(4-keto-4-phenyl-butanoyl)oxymethyl]thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C19H19NO7S MolecularWeight: 405.42166

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19NO7S/c1-25-18(23)15-12(16(19(24)26-2)28-17(15)20)10-27-14(22)9-8-13(21)11-6-4-3-5-7-11/h3-7H,8-10,20H2,1-2H3