[2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxidanylidene-ethyl] 3-azanyl-4-chloranyl-benzoate Openeye Name: [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxo-ethyl] 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(2,4-dichlorophenyl)ethylamino]-2-oxoethyl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [2-[2-(2,4-dichlorophenyl)ethylamino]-2-keto-ethyl] ester Formula: C17H15Cl3N2O3 MolecularWeight: 401.6716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)OCC(=O)NCCC2=C(C=C(C=C2)Cl)Cl)N)Cl

Isomeric SMILES

C1=CC(=C(C=C1C(=O)OCC(=O)NCCC2=C(C=C(C=C2)Cl)Cl)N)Cl

InChI

InChI=1S/C17H15Cl3N2O3/c18-12-3-1-10(14(20)8-12)5-6-22-16(23)9-25-17(24)11-2-4-13(19)15(21)7-11/h1-4,7-8H,5-6,9,21H2,(H,22,23)