dimethyl 3-[[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxymethyl]-5-azanyl-thiophene-2,4-dicarboxylate

Systemtic Name: dimethyl 3-[[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxymethyl]-5-azanyl-thiophene-2,4-dicarboxylate Openeye Name: dimethyl 3-[[(Z)-2-acetamido-3-phenyl-prop-2-enoyl]oxymethyl]-5-amino-thiophene-2,4-dicarboxylate CAS Name: 3-[[(Z)-2-acetamido-1-oxo-3-phenylprop-2-enoxy]methyl]-5-aminothiophene-2,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-[[(Z)-2-acetamido-3-phenylprop-2-enoyl]oxymethyl]-5-aminothiophene-2,4-dicarboxylate Traditional Name: 3-[[(Z)-2-acetamido-3-phenyl-acryloyl]oxymethyl]-5-amino-thiophene-2,4-dicarboxylic acid dimethyl ester Formula: C20H20N2O7S MolecularWeight: 432.447

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=CC1=CC=CC=C1)C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

Isomeric SMILES

CC(=O)N/C(=C\C1=CC=CC=C1)/C(=O)OCC2=C(SC(=C2C(=O)OC)N)C(=O)OC

InChI

InChI=1S/C20H20N2O7S/c1-11(23)22-14(9-12-7-5-4-6-8-12)18(24)29-10-13-15(19(25)27-2)17(21)30-16(13)20(26)28-3/h4-9H,10,21H2,1-3H3,(H,22,23)/b14-9-