[(2S)-1-[(2,5-dimethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-chloranylbenzoate

Systemtic Name: [(2S)-1-[(2,5-dimethoxyphenyl)amino]-1-oxidanylidene-propan-2-yl] 4-chloranylbenzoate Openeye Name: [(1S)-2-(2,5-dimethoxyanilino)-1-methyl-2-oxo-ethyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [(2S)-1-(2,5-dimethoxyanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2,5-dimethoxyanilino)-1-oxopropan-2-yl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [(1S)-2-(2,5-dimethoxyanilino)-2-keto-1-methyl-ethyl] ester Formula: C18H18ClNO5 MolecularWeight: 363.79222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)OC)OC)OC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=CC(=C1)OC)OC)OC(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C18H18ClNO5/c1-11(25-18(22)12-4-6-13(19)7-5-12)17(21)20-15-10-14(23-2)8-9-16(15)24-3/h4-11H,1-3H3,(H,20,21)/t11-/m0/s1