O4-[(5-azanyl-4-cyano-2-ethoxycarbonyl-thiophen-3-yl)methyl] O1-methyl benzene-1,4-dicarboxylate

Systemtic Name: O4-[(5-azanyl-4-cyano-2-ethoxycarbonyl-thiophen-3-yl)methyl] O1-methyl benzene-1,4-dicarboxylate Openeye Name: O4-[(5-amino-4-cyano-2-ethoxycarbonyl-3-thienyl)methyl] O1-methyl benzene-1,4-dicarboxylate CAS Name: benzene-1,4-dicarboxylic acid O4-[(5-amino-4-cyano-2-ethoxycarbonyl-3-thiophenyl)methyl] ester O1-methyl ester IUPAC Name: 4-O-[(5-amino-4-cyano-2-ethoxycarbonylthiophen-3-yl)methyl] 1-O-methyl benzene-1,4-dicarboxylate Traditional Name: benzene-1,4-dicarboxylic acid O4-[(5-amino-2-carbethoxy-4-cyano-3-thienyl)methyl] ester O1-methyl ester Formula: C18H16N2O6S MolecularWeight: 388.39444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16N2O6S/c1-3-25-18(23)14-13(12(8-19)15(20)27-14)9-26-17(22)11-6-4-10(5-7-11)16(21)24-2/h4-7H,3,9,20H2,1-2H3