5-[4-(4-cyanophenyl)butylamino]-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: 5-[4-(4-cyanophenyl)butylamino]-5-oxidanylidene-2-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-5-[4-(4-cyanophenyl)butylamino]-5-oxo-pentanoic acid CAS Name: 5-[4-(4-cyanophenyl)butylamino]-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: 5-[4-(4-cyanophenyl)butylamino]-5-oxo-2-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-5-[4-(4-cyanophenyl)butylamino]-5-keto-valeric acid Formula: C24H27N3O5 MolecularWeight: 437.48828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCC(=O)NCCCCC2=CC=C(C=C2)C#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCC(=O)NCCCCC2=CC=C(C=C2)C#N)C(=O)O

InChI

InChI=1S/C24H27N3O5/c25-16-19-11-9-18(10-12-19)6-4-5-15-26-22(28)14-13-21(23(29)30)27-24(31)32-17-20-7-2-1-3-8-20/h1-3,7-12,21H,4-6,13-15,17H2,(H,26,28)(H,27,31)(H,29,30)