4-(dibutylcarbamoyl)-5-[(3,4-dichlorophenyl)amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-(dibutylcarbamoyl)-5-[(3,4-dichlorophenyl)amino]-5-oxidanylidene-pentanoic acid Openeye Name: 4-(dibutylcarbamoyl)-5-(3,4-dichloroanilino)-5-oxo-pentanoic acid CAS Name: 4-[(dibutylamino)-oxomethyl]-5-(3,4-dichloroanilino)-5-oxopentanoic acid IUPAC Name: 4-(dibutylcarbamoyl)-5-(3,4-dichloroanilino)-5-oxopentanoic acid Traditional Name: 4-(dibutylcarbamoyl)-5-(3,4-dichloroanilino)-5-keto-valeric acid Formula: C20H28Cl2N2O4 MolecularWeight: 431.35332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)C(CCC(=O)O)C(=O)NC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CCCCN(CCCC)C(=O)C(CCC(=O)O)C(=O)NC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C20H28Cl2N2O4/c1-3-5-11-24(12-6-4-2)20(28)15(8-10-18(25)26)19(27)23-14-7-9-16(21)17(22)13-14/h7,9,13,15H,3-6,8,10-12H2,1-2H3,(H,23,27)(H,25,26)