[4-(2-azanyl-3-cyano-5-oxidanylidene-4H-pyrano[3,2-c]chromen-4-yl)-2-ethoxy-6-nitro-phenyl] thiophene-2-carboxylate

Systemtic Name: [4-(2-azanyl-3-cyano-5-oxidanylidene-4H-pyrano[3,2-c]chromen-4-yl)-2-ethoxy-6-nitro-phenyl] thiophene-2-carboxylate Openeye Name: [4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)-2-ethoxy-6-nitro-phenyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c][1]benzopyran-4-yl)-2-ethoxy-6-nitrophenyl] ester IUPAC Name: [4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)-2-ethoxy-6-nitrophenyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [4-(2-amino-3-cyano-5-keto-4H-pyrano[3,2-c]chromen-4-yl)-2-ethoxy-6-nitro-phenyl] ester Formula: C26H17N3O8S MolecularWeight: 531.49348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OC(=O)C2=CC=CS2)[N+](=O)[O-])C3C(=C(OC4=C3C(=O)OC5=CC=CC=C54)N)C#N

Isomeric SMILES

CCOC1=CC(=CC(=C1OC(=O)C2=CC=CS2)[N+](=O)[O-])C3C(=C(OC4=C3C(=O)OC5=CC=CC=C54)N)C#N

InChI

InChI=1S/C26H17N3O8S/c1-2-34-18-11-13(10-16(29(32)33)23(18)37-25(30)19-8-5-9-38-19)20-15(12-27)24(28)36-22-14-6-3-4-7-17(14)35-26(31)21(20)22/h3-11,20H,2,28H2,1H3