[2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] 4-chloranyl-2-oxidanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] 4-chloranyl-2-oxidanyl-benzoate Openeye Name: [2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] 4-chloro-2-hydroxy-benzoate CAS Name: 4-chloro-2-hydroxybenzoic acid [2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] ester IUPAC Name: [2-oxo-2-[(3,4,5-trimethoxyphenyl)methylamino]ethyl] 4-chloro-2-hydroxybenzoate Traditional Name: 4-chloro-2-hydroxy-benzoic acid [2-keto-2-[(3,4,5-trimethoxybenzyl)amino]ethyl] ester Formula: C19H20ClNO7 MolecularWeight: 409.8176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)COC(=O)C2=C(C=C(C=C2)Cl)O

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)COC(=O)C2=C(C=C(C=C2)Cl)O

InChI

InChI=1S/C19H20ClNO7/c1-25-15-6-11(7-16(26-2)18(15)27-3)9-21-17(23)10-28-19(24)13-5-4-12(20)8-14(13)22/h4-8,22H,9-10H2,1-3H3,(H,21,23)