methyl 4-[(7-cyanonaphthalen-1-yl)methyl]-3-methoxy-benzoate

Systemtic Name: methyl 4-[(7-cyanonaphthalen-1-yl)methyl]-3-methoxy-benzoate Openeye Name: methyl 4-[(7-cyano-1-naphthyl)methyl]-3-methoxy-benzoate CAS Name: 4-[(7-cyano-1-naphthalenyl)methyl]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[(7-cyanonaphthalen-1-yl)methyl]-3-methoxybenzoate Traditional Name: 4-[(7-cyano-1-naphthyl)methyl]-3-methoxy-benzoic acid methyl ester Formula: C21H17NO3 MolecularWeight: 331.36458

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)CC2=CC=CC3=C2C=C(C=C3)C#N

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)CC2=CC=CC3=C2C=C(C=C3)C#N

InChI

InChI=1S/C21H17NO3/c1-24-20-12-18(21(23)25-2)9-8-17(20)11-16-5-3-4-15-7-6-14(13-22)10-19(15)16/h3-10,12H,11H2,1-2H3