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

Systemtic Name: 4-[(3,4-dichlorophenyl)amino]-2-(2-diethylaminoethylamino)-4-oxidanylidene-butanoic acid Openeye Name: 4-(3,4-dichloroanilino)-2-(2-diethylaminoethylamino)-4-oxo-butanoic acid CAS Name: 4-(3,4-dichloroanilino)-2-(2-diethylaminoethylamino)-4-oxobutanoic acid IUPAC Name: 4-(3,4-dichloroanilino)-2-(2-diethylaminoethylamino)-4-oxobutanoic acid Traditional Name: 4-(3,4-dichloroanilino)-2-(2-diethylaminoethylamino)-4-keto-butyric acid Formula: C16H23Cl2N3O3 MolecularWeight: 376.27812

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23Cl2N3O3/c1-3-21(4-2)8-7-19-14(16(23)24)10-15(22)20-11-5-6-12(17)13(18)9-11/h5-6,9,14,19H,3-4,7-8,10H2,1-2H3,(H,20,22)(H,23,24)