methyl 4-[2-[[2-(2-chlorophenyl)-2-oxidanyl-ethyl]amino]ethyl]benzoate

Systemtic Name: methyl 4-[2-[[2-(2-chlorophenyl)-2-oxidanyl-ethyl]amino]ethyl]benzoate Openeye Name: methyl 4-[2-[[2-(2-chlorophenyl)-2-hydroxy-ethyl]amino]ethyl]benzoate CAS Name: 4-[2-[[2-(2-chlorophenyl)-2-hydroxyethyl]amino]ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[[2-(2-chlorophenyl)-2-hydroxyethyl]amino]ethyl]benzoate Traditional Name: 4-[2-[[2-(2-chlorophenyl)-2-hydroxy-ethyl]amino]ethyl]benzoic acid methyl ester Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCNCC(C2=CC=CC=C2Cl)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCNCC(C2=CC=CC=C2Cl)O

InChI

InChI=1S/C18H20ClNO3/c1-23-18(22)14-8-6-13(7-9-14)10-11-20-12-17(21)15-4-2-3-5-16(15)19/h2-9,17,20-21H,10-12H2,1H3