methyl 3-[(4-cyanophenyl)-oxidanyl-methyl]benzoate

Systemtic Name: methyl 3-[(4-cyanophenyl)-oxidanyl-methyl]benzoate Openeye Name: methyl 3-[(4-cyanophenyl)-hydroxy-methyl]benzoate CAS Name: 3-[(4-cyanophenyl)-hydroxymethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[(4-cyanophenyl)-hydroxymethyl]benzoate Traditional Name: 3-[(4-cyanophenyl)-hydroxy-methyl]benzoic acid methyl ester Formula: C16H13NO3 MolecularWeight: 267.27932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC=C1)C(C2=CC=C(C=C2)C#N)O

Isomeric SMILES

COC(=O)C1=CC(=CC=C1)C(C2=CC=C(C=C2)C#N)O

InChI

InChI=1S/C16H13NO3/c1-20-16(19)14-4-2-3-13(9-14)15(18)12-7-5-11(10-17)6-8-12/h2-9,15,18H,1H3