methyl 4-[[butyl(cyclohexylmethyl)amino]oxymethyl]-2-(2-methylphenyl)benzoate

Systemtic Name: methyl 4-[[butyl(cyclohexylmethyl)amino]oxymethyl]-2-(2-methylphenyl)benzoate Openeye Name: methyl 4-[[butyl(cyclohexylmethyl)amino]oxymethyl]-2-(o-tolyl)benzoate CAS Name: 4-[[butyl(cyclohexylmethyl)amino]oxymethyl]-2-(2-methylphenyl)benzoic acid methyl ester IUPAC Name: methyl 4-[[butyl(cyclohexylmethyl)amino]oxymethyl]-2-(2-methylphenyl)benzoate Traditional Name: 4-[[butyl(cyclohexylmethyl)amino]oxymethyl]-2-(o-tolyl)benzoic acid methyl ester Formula: C27H37NO3 MolecularWeight: 423.58758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1CCCCC1)OCC2=CC(=C(C=C2)C(=O)OC)C3=CC=CC=C3C

Isomeric SMILES

CCCCN(CC1CCCCC1)OCC2=CC(=C(C=C2)C(=O)OC)C3=CC=CC=C3C

InChI

InChI=1S/C27H37NO3/c1-4-5-17-28(19-22-12-7-6-8-13-22)31-20-23-15-16-25(27(29)30-3)26(18-23)24-14-10-9-11-21(24)2/h9-11,14-16,18,22H,4-8,12-13,17,19-20H2,1-3H3