[4-(2-azanyl-3-cyano-5-oxidanylidene-4H-pyrano[3,2-c]chromen-4-yl)-2,6-dimethoxy-phenyl] benzoate

Systemtic Name: [4-(2-azanyl-3-cyano-5-oxidanylidene-4H-pyrano[3,2-c]chromen-4-yl)-2,6-dimethoxy-phenyl] benzoate Openeye Name: [4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)-2,6-dimethoxy-phenyl] benzoate CAS Name: benzoic acid [4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c][1]benzopyran-4-yl)-2,6-dimethoxyphenyl] ester IUPAC Name: [4-(2-amino-3-cyano-5-oxo-4H-pyrano[3,2-c]chromen-4-yl)-2,6-dimethoxyphenyl] benzoate Traditional Name: benzoic acid [4-(2-amino-3-cyano-5-keto-4H-pyrano[3,2-c]chromen-4-yl)-2,6-dimethoxy-phenyl] ester Formula: C28H20N2O7 MolecularWeight: 496.4676

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC(=O)C2=CC=CC=C2)OC)C3C(=C(OC4=C3C(=O)OC5=CC=CC=C54)N)C#N

Isomeric SMILES

COC1=CC(=CC(=C1OC(=O)C2=CC=CC=C2)OC)C3C(=C(OC4=C3C(=O)OC5=CC=CC=C54)N)C#N

InChI

InChI=1S/C28H20N2O7/c1-33-20-12-16(13-21(34-2)25(20)37-27(31)15-8-4-3-5-9-15)22-18(14-29)26(30)36-24-17-10-6-7-11-19(17)35-28(32)23(22)24/h3-13,22H,30H2,1-2H3