ethyl 2-azanyl-3-cyano-5-(4-methoxyphenyl)carbonyl-4-oxidanyl-benzoate

Systemtic Name: ethyl 2-azanyl-3-cyano-5-(4-methoxyphenyl)carbonyl-4-oxidanyl-benzoate Openeye Name: ethyl 2-amino-3-cyano-4-hydroxy-5-(4-methoxybenzoyl)benzoate CAS Name: 2-amino-3-cyano-4-hydroxy-5-[(4-methoxyphenyl)-oxomethyl]benzoic acid ethyl ester IUPAC Name: ethyl 2-amino-3-cyano-4-hydroxy-5-(4-methoxybenzoyl)benzoate Traditional Name: 2-amino-3-cyano-4-hydroxy-5-p-anisoyl-benzoic acid ethyl ester Formula: C18H16N2O5 MolecularWeight: 340.33004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C(=C1N)C#N)O)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1=CC(=C(C(=C1N)C#N)O)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C18H16N2O5/c1-3-25-18(23)12-8-13(17(22)14(9-19)15(12)20)16(21)10-4-6-11(24-2)7-5-10/h4-8,22H,3,20H2,1-2H3