phenethyl 3-methylbenzoate

Systemtic Name: phenethyl 3-methylbenzoate Openeye Name: phenethyl 3-methylbenzoate CAS Name: 3-methylbenzoic acid phenethyl ester IUPAC Name: phenethyl 3-methylbenzoate Traditional Name: 3-methylbenzoic acid phenethyl ester Formula: C16H16O2 MolecularWeight: 240.29704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OCCC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OCCC2=CC=CC=C2

InChI

InChI=1S/C16H16O2/c1-13-6-5-9-15(12-13)16(17)18-11-10-14-7-3-2-4-8-14/h2-9,12H,10-11H2,1H3