[2-azanyl-1-(4-fluorophenyl)-2-oxidanylidene-ethyl] 2,4,6-trimethylbenzoate

Systemtic Name: [2-azanyl-1-(4-fluorophenyl)-2-oxidanylidene-ethyl] 2,4,6-trimethylbenzoate Openeye Name: [2-amino-1-(4-fluorophenyl)-2-oxo-ethyl] 2,4,6-trimethylbenzoate CAS Name: 2,4,6-trimethylbenzoic acid [2-amino-1-(4-fluorophenyl)-2-oxoethyl] ester IUPAC Name: [2-amino-1-(4-fluorophenyl)-2-oxoethyl] 2,4,6-trimethylbenzoate Traditional Name: 2,4,6-trimethylbenzoic acid [2-amino-1-(4-fluorophenyl)-2-keto-ethyl] ester Formula: C18H18FNO3 MolecularWeight: 315.338823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)C(=O)OC(C2=CC=C(C=C2)F)C(=O)N)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)C(=O)OC(C2=CC=C(C=C2)F)C(=O)N)C

InChI

InChI=1S/C18H18FNO3/c1-10-8-11(2)15(12(3)9-10)18(22)23-16(17(20)21)13-4-6-14(19)7-5-13/h4-9,16H,1-3H3,(H2,20,21)