4-[(4-chlorophenyl)carbamoylamino]-5-(dipentylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: 4-[(4-chlorophenyl)carbamoylamino]-5-(dipentylamino)-5-oxidanylidene-pentanoic acid Openeye Name: 4-[(4-chlorophenyl)carbamoylamino]-5-(dipentylamino)-5-oxo-pentanoic acid CAS Name: 4-[[(4-chloroanilino)-oxomethyl]amino]-5-(dipentylamino)-5-oxopentanoic acid IUPAC Name: 4-[(4-chlorophenyl)carbamoylamino]-5-(dipentylamino)-5-oxopentanoic acid Traditional Name: 4-[(4-chlorophenyl)carbamoylamino]-5-(diamylamino)-5-keto-valeric acid Formula: C22H34ClN3O4 MolecularWeight: 439.97606

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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

Isomeric SMILES

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

InChI

InChI=1S/C22H34ClN3O4/c1-3-5-7-15-26(16-8-6-4-2)21(29)19(13-14-20(27)28)25-22(30)24-18-11-9-17(23)10-12-18/h9-12,19H,3-8,13-16H2,1-2H3,(H,27,28)(H2,24,25,30)