[2-(dicyclohexylamino)-2-oxidanylidene-ethyl] 2-(4-methylphenyl)carbonylbenzoate

Systemtic Name: [2-(dicyclohexylamino)-2-oxidanylidene-ethyl] 2-(4-methylphenyl)carbonylbenzoate Openeye Name: [2-(dicyclohexylamino)-2-oxo-ethyl] 2-(4-methylbenzoyl)benzoate CAS Name: 2-[(4-methylphenyl)-oxomethyl]benzoic acid [2-(dicyclohexylamino)-2-oxoethyl] ester IUPAC Name: [2-(dicyclohexylamino)-2-oxoethyl] 2-(4-methylbenzoyl)benzoate Traditional Name: 2-p-toluoylbenzoic acid [2-(dicyclohexylamino)-2-keto-ethyl] ester Formula: C29H35NO4 MolecularWeight: 461.5925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC(=O)N(C3CCCCC3)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC(=O)N(C3CCCCC3)C4CCCCC4

InChI

InChI=1S/C29H35NO4/c1-21-16-18-22(19-17-21)28(32)25-14-8-9-15-26(25)29(33)34-20-27(31)30(23-10-4-2-5-11-23)24-12-6-3-7-13-24/h8-9,14-19,23-24H,2-7,10-13,20H2,1H3