methyl 4-[2-[[2-(2-chloranyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]amino]propyl]benzoate

Systemtic Name: methyl 4-[2-[[2-(2-chloranyl-4-oxidanyl-phenyl)-2-oxidanyl-ethyl]amino]propyl]benzoate Openeye Name: methyl 4-[2-[[2-(2-chloro-4-hydroxy-phenyl)-2-hydroxy-ethyl]amino]propyl]benzoate CAS Name: 4-[2-[[2-(2-chloro-4-hydroxyphenyl)-2-hydroxyethyl]amino]propyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[2-(2-chloro-4-hydroxyphenyl)-2-hydroxyethyl]amino]propyl]benzoate Traditional Name: 4-[2-[[2-(2-chloro-4-hydroxy-phenyl)-2-hydroxy-ethyl]amino]propyl]benzoic acid methyl ester Formula: C19H22ClNO4 MolecularWeight: 363.83528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)C(=O)OC)NCC(C2=C(C=C(C=C2)O)Cl)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)C(=O)OC)NCC(C2=C(C=C(C=C2)O)Cl)O

InChI

InChI=1S/C19H22ClNO4/c1-12(9-13-3-5-14(6-4-13)19(24)25-2)21-11-18(23)16-8-7-15(22)10-17(16)20/h3-8,10,12,18,21-23H,9,11H2,1-2H3