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

Systemtic Name: ethyl 4-azanyl-5-cyano-2-oxidanyl-3-(phenylmethyl)benzoate Openeye Name: ethyl 4-amino-3-benzyl-5-cyano-2-hydroxy-benzoate CAS Name: 4-amino-5-cyano-2-hydroxy-3-(phenylmethyl)benzoic acid ethyl ester IUPAC Name: ethyl 4-amino-3-benzyl-5-cyano-2-hydroxybenzoate Traditional Name: 4-amino-3-benzyl-5-cyano-2-hydroxy-benzoic acid ethyl ester Formula: C17H16N2O3 MolecularWeight: 296.32054

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C(=C1)C#N)N)CC2=CC=CC=C2)O

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C(=C1)C#N)N)CC2=CC=CC=C2)O

InChI

InChI=1S/C17H16N2O3/c1-2-22-17(21)14-9-12(10-18)15(19)13(16(14)20)8-11-6-4-3-5-7-11/h3-7,9,20H,2,8,19H2,1H3