3-[[2-(3,4-dichlorophenyl)-2-oxidanyl-ethyl]amino]-3-oxidanyl-2-(phenoxymethyl)propanoate

Systemtic Name: 3-[[2-(3,4-dichlorophenyl)-2-oxidanyl-ethyl]amino]-3-oxidanyl-2-(phenoxymethyl)propanoate Openeye Name: 3-[[2-(3,4-dichlorophenyl)-2-hydroxy-ethyl]amino]-3-hydroxy-2-(phenoxymethyl)propanoate CAS Name: 3-[[2-(3,4-dichlorophenyl)-2-hydroxyethyl]amino]-3-hydroxy-2-(phenoxymethyl)propanoate IUPAC Name: 3-[[2-(3,4-dichlorophenyl)-2-hydroxyethyl]amino]-3-hydroxy-2-(phenoxymethyl)propanoate Traditional Name: 3-[[2-(3,4-dichlorophenyl)-2-hydroxy-ethyl]amino]-3-hydroxy-2-(phenoxymethyl)propionate Formula: C18H18Cl2NO5- MolecularWeight: 399.24522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(C(NCC(C2=CC(=C(C=C2)Cl)Cl)O)O)C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)OCC(C(NCC(C2=CC(=C(C=C2)Cl)Cl)O)O)C(=O)[O-]

InChI

InChI=1S/C18H19Cl2NO5/c19-14-7-6-11(8-15(14)20)16(22)9-21-17(23)13(18(24)25)10-26-12-4-2-1-3-5-12/h1-8,13,16-17,21-23H,9-10H2,(H,24,25)/p-1