(5-azanyl-4-cyano-2-ethoxycarbonyl-thiophen-3-yl)methyl 2H-chromene-3-carboxylate

Systemtic Name: (5-azanyl-4-cyano-2-ethoxycarbonyl-thiophen-3-yl)methyl 2H-chromene-3-carboxylate Openeye Name: (5-amino-4-cyano-2-ethoxycarbonyl-3-thienyl)methyl 2H-chromene-3-carboxylate CAS Name: 2H-1-benzopyran-3-carboxylic acid (5-amino-4-cyano-2-ethoxycarbonyl-3-thiophenyl)methyl ester IUPAC Name: (5-amino-4-cyano-2-ethoxycarbonylthiophen-3-yl)methyl 2H-chromene-3-carboxylate Traditional Name: 2H-chromene-3-carboxylic acid (5-amino-2-carbethoxy-4-cyano-3-thienyl)methyl ester Formula: C19H16N2O5S MolecularWeight: 384.40574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC3=CC=CC=C3OC2

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC3=CC=CC=C3OC2

InChI

InChI=1S/C19H16N2O5S/c1-2-24-19(23)16-14(13(8-20)17(21)27-16)10-26-18(22)12-7-11-5-3-4-6-15(11)25-9-12/h3-7H,2,9-10,21H2,1H3