methyl 2-(2-methylphenyl)-4-propyl-benzoate

Systemtic Name: methyl 2-(2-methylphenyl)-4-propyl-benzoate Openeye Name: methyl 2-(o-tolyl)-4-propyl-benzoate CAS Name: 2-(2-methylphenyl)-4-propylbenzoic acid methyl ester IUPAC Name: methyl 2-(2-methylphenyl)-4-propylbenzoate Traditional Name: 2-(o-tolyl)-4-propyl-benzoic acid methyl ester Formula: C18H20O2 MolecularWeight: 268.3502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)C(=O)OC)C2=CC=CC=C2C

Isomeric SMILES

CCCC1=CC(=C(C=C1)C(=O)OC)C2=CC=CC=C2C

InChI

InChI=1S/C18H20O2/c1-4-7-14-10-11-16(18(19)20-3)17(12-14)15-9-6-5-8-13(15)2/h5-6,8-12H,4,7H2,1-3H3