ethyl 3-[(4-cyanophenyl)methyl]-2-methyl-4-oxidanyl-benzoate

Systemtic Name: ethyl 3-[(4-cyanophenyl)methyl]-2-methyl-4-oxidanyl-benzoate Openeye Name: ethyl 3-[(4-cyanophenyl)methyl]-4-hydroxy-2-methyl-benzoate CAS Name: 3-[(4-cyanophenyl)methyl]-4-hydroxy-2-methylbenzoic acid ethyl ester IUPAC Name: ethyl 3-[(4-cyanophenyl)methyl]-4-hydroxy-2-methylbenzoate Traditional Name: 3-(4-cyanobenzyl)-4-hydroxy-2-methyl-benzoic acid ethyl ester Formula: C18H17NO3 MolecularWeight: 295.33248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17NO3/c1-3-22-18(21)15-8-9-17(20)16(12(15)2)10-13-4-6-14(11-19)7-5-13/h4-9,20H,3,10H2,1-2H3