4-[2-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]propyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[2-[[2-(3-chlorophenyl)-2-oxidanyl-ethyl]amino]propyl]-3-methoxy-benzoic acid Openeye Name: 4-[2-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]propyl]-3-methoxy-benzoic acid CAS Name: 4-[2-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]-3-methoxybenzoic acid IUPAC Name: 4-[2-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]-3-methoxybenzoic acid Traditional Name: 4-[2-[[2-(3-chlorophenyl)-2-hydroxy-ethyl]amino]propyl]-3-methoxy-benzoic acid Formula: C19H22ClNO4 MolecularWeight: 363.83528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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