ethyl 2-azanyl-3-cyano-4-(3,4-dimethoxyphenyl)-9-oxidanyl-4H-benzo[h]chromene-8-carboxylate

Systemtic Name: ethyl 2-azanyl-3-cyano-4-(3,4-dimethoxyphenyl)-9-oxidanyl-4H-benzo[h]chromene-8-carboxylate Openeye Name: ethyl 2-amino-3-cyano-4-(3,4-dimethoxyphenyl)-9-hydroxy-4H-benzo[h]chromene-8-carboxylate CAS Name: 2-amino-3-cyano-4-(3,4-dimethoxyphenyl)-9-hydroxy-4H-benzo[h][1]benzopyran-8-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-3-cyano-4-(3,4-dimethoxyphenyl)-9-hydroxy-4H-benzo[h]chromene-8-carboxylate Traditional Name: 2-amino-3-cyano-4-(3,4-dimethoxyphenyl)-9-hydroxy-4H-benzo[h]chromene-8-carboxylic acid ethyl ester Formula: C25H22N2O6 MolecularWeight: 446.45198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C2C(=C1)C=CC3=C2OC(=C(C3C4=CC(=C(C=C4)OC)OC)C#N)N)O

Isomeric SMILES

CCOC(=O)C1=C(C=C2C(=C1)C=CC3=C2OC(=C(C3C4=CC(=C(C=C4)OC)OC)C#N)N)O

InChI

InChI=1S/C25H22N2O6/c1-4-32-25(29)17-9-13-5-7-15-22(14-6-8-20(30-2)21(10-14)31-3)18(12-26)24(27)33-23(15)16(13)11-19(17)28/h5-11,22,28H,4,27H2,1-3H3