[1-[2-(4-methoxyphenyl)ethylamino]-1-oxidanylidene-propan-2-yl] 2,4-dimethylbenzoate

Systemtic Name: [1-[2-(4-methoxyphenyl)ethylamino]-1-oxidanylidene-propan-2-yl] 2,4-dimethylbenzoate Openeye Name: [2-[2-(4-methoxyphenyl)ethylamino]-1-methyl-2-oxo-ethyl] 2,4-dimethylbenzoate CAS Name: 2,4-dimethylbenzoic acid [1-[2-(4-methoxyphenyl)ethylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[2-(4-methoxyphenyl)ethylamino]-1-oxopropan-2-yl] 2,4-dimethylbenzoate Traditional Name: 2,4-dimethylbenzoic acid [2-keto-2-[2-(4-methoxyphenyl)ethylamino]-1-methyl-ethyl] ester Formula: C21H25NO4 MolecularWeight: 355.4275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)OC(C)C(=O)NCCC2=CC=C(C=C2)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)OC(C)C(=O)NCCC2=CC=C(C=C2)OC)C

InChI

InChI=1S/C21H25NO4/c1-14-5-10-19(15(2)13-14)21(24)26-16(3)20(23)22-12-11-17-6-8-18(25-4)9-7-17/h5-10,13,16H,11-12H2,1-4H3,(H,22,23)