[2-oxidanylidene-2-[3-(2,3,5-trimethylphenoxy)propylamino]ethyl] 4-azanylbenzoate

Systemtic Name: [2-oxidanylidene-2-[3-(2,3,5-trimethylphenoxy)propylamino]ethyl] 4-azanylbenzoate Openeye Name: [2-oxo-2-[3-(2,3,5-trimethylphenoxy)propylamino]ethyl] 4-aminobenzoate CAS Name: 4-aminobenzoic acid [2-oxo-2-[3-(2,3,5-trimethylphenoxy)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-[3-(2,3,5-trimethylphenoxy)propylamino]ethyl] 4-aminobenzoate Traditional Name: 4-aminobenzoic acid [2-keto-2-[3-(2,3,5-trimethylphenoxy)propylamino]ethyl] ester Formula: C21H26N2O4 MolecularWeight: 370.44214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OCCCNC(=O)COC(=O)C2=CC=C(C=C2)N)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OCCCNC(=O)COC(=O)C2=CC=C(C=C2)N)C)C

InChI

InChI=1S/C21H26N2O4/c1-14-11-15(2)16(3)19(12-14)26-10-4-9-23-20(24)13-27-21(25)17-5-7-18(22)8-6-17/h5-8,11-12H,4,9-10,13,22H2,1-3H3,(H,23,24)