4-[(3-chlorophenyl)amino]-2-(2-diethylaminoethylamino)-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-chlorophenyl)amino]-2-(2-diethylaminoethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(3-chloroanilino)-2-(2-diethylaminoethylamino)-4-oxo-butanoic acid CAS Name: 4-(3-chloroanilino)-2-(2-diethylaminoethylamino)-4-oxobutanoic acid IUPAC Name: 4-(3-chloroanilino)-2-(2-diethylaminoethylamino)-4-oxobutanoic acid Traditional Name: 4-(3-chloroanilino)-2-(2-diethylaminoethylamino)-4-keto-butyric acid Formula: C16H24ClN3O3 MolecularWeight: 341.83306

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(CC(=O)NC1=CC(=CC=C1)Cl)C(=O)O

Isomeric SMILES

CCN(CC)CCNC(CC(=O)NC1=CC(=CC=C1)Cl)C(=O)O

InChI

InChI=1S/C16H24ClN3O3/c1-3-20(4-2)9-8-18-14(16(22)23)11-15(21)19-13-7-5-6-12(17)10-13/h5-7,10,14,18H,3-4,8-9,11H2,1-2H3,(H,19,21)(H,22,23)