4-[(3,4-dichlorophenyl)carbamoylamino]-5-(dipentylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[(3,4-dichlorophenyl)carbamoylamino]-5-(dipentylamino)-5-oxidanylidene-pentanoic acid Openeye Name: 4-[(3,4-dichlorophenyl)carbamoylamino]-5-(dipentylamino)-5-oxo-pentanoic acid CAS Name: 4-[[(3,4-dichloroanilino)-oxomethyl]amino]-5-(dipentylamino)-5-oxopentanoic acid IUPAC Name: 4-[(3,4-dichlorophenyl)carbamoylamino]-5-(dipentylamino)-5-oxopentanoic acid Traditional Name: 5-(diamylamino)-4-[(3,4-dichlorophenyl)carbamoylamino]-5-keto-valeric acid Formula: C22H33Cl2N3O4 MolecularWeight: 474.42112

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)NC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CCCCCN(CCCCC)C(=O)C(CCC(=O)O)NC(=O)NC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C22H33Cl2N3O4/c1-3-5-7-13-27(14-8-6-4-2)21(30)19(11-12-20(28)29)26-22(31)25-16-9-10-17(23)18(24)15-16/h9-10,15,19H,3-8,11-14H2,1-2H3,(H,28,29)(H2,25,26,31)