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

Systemtic Name: ethyl 2-azanyl-3-cyano-4-(3,4-dichlorophenyl)-9-oxidanyl-4H-benzo[h]chromene-8-carboxylate Openeye Name: ethyl 2-amino-3-cyano-4-(3,4-dichlorophenyl)-9-hydroxy-4H-benzo[h]chromene-8-carboxylate CAS Name: 2-amino-3-cyano-4-(3,4-dichlorophenyl)-9-hydroxy-4H-benzo[h][1]benzopyran-8-carboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-3-cyano-4-(3,4-dichlorophenyl)-9-hydroxy-4H-benzo[h]chromene-8-carboxylate Traditional Name: 2-amino-3-cyano-4-(3,4-dichlorophenyl)-9-hydroxy-4H-benzo[h]chromene-8-carboxylic acid ethyl ester Formula: C23H16Cl2N2O4 MolecularWeight: 455.29014

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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)Cl)Cl)C#N)N)O

Isomeric SMILES

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

InChI

InChI=1S/C23H16Cl2N2O4/c1-2-30-23(29)15-7-11-3-5-13-20(12-4-6-17(24)18(25)8-12)16(10-26)22(27)31-21(13)14(11)9-19(15)28/h3-9,20,28H,2,27H2,1H3