O4-ethyl O2-prop-2-enyl 3-methyl-5-[2-(3-nitrophenoxy)ethanoylamino]thiophene-2,4-dicarboxylate

Systemtic Name: O4-ethyl O2-prop-2-enyl 3-methyl-5-[2-(3-nitrophenoxy)ethanoylamino]thiophene-2,4-dicarboxylate Openeye Name: O2-allyl O4-ethyl 3-methyl-5-[[2-(3-nitrophenoxy)acetyl]amino]thiophene-2,4-dicarboxylate CAS Name: 3-methyl-5-[[2-(3-nitrophenoxy)-1-oxoethyl]amino]thiophene-2,4-dicarboxylic acid O4-ethyl ester O2-prop-2-enyl ester IUPAC Name: 4-O-ethyl 2-O-prop-2-enyl 3-methyl-5-[[2-(3-nitrophenoxy)acetyl]amino]thiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-[[2-(3-nitrophenoxy)acetyl]amino]thiophene-2,4-dicarboxylic acid O2-allyl ester O4-ethyl ester Formula: C20H20N2O8S MolecularWeight: 448.4464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC=C)NC(=O)COC2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC=C)NC(=O)COC2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C20H20N2O8S/c1-4-9-29-20(25)17-12(3)16(19(24)28-5-2)18(31-17)21-15(23)11-30-14-8-6-7-13(10-14)22(26)27/h4,6-8,10H,1,5,9,11H2,2-3H3,(H,21,23)