3-[[4-(4-cyanophenyl)phenyl]-ethyl-carbamoyl]-5-(oxidanylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: 3-[[4-(4-cyanophenyl)phenyl]-ethyl-carbamoyl]-5-(oxidanylamino)-5-oxidanylidene-pentanoic acid Openeye Name: 3-[[4-(4-cyanophenyl)phenyl]-ethyl-carbamoyl]-5-(hydroxyamino)-5-oxo-pentanoic acid CAS Name: 3-[[4-(4-cyanophenyl)-N-ethylanilino]-oxomethyl]-5-(hydroxyamino)-5-oxopentanoic acid IUPAC Name: 3-[[4-(4-cyanophenyl)phenyl]-ethylcarbamoyl]-5-(hydroxyamino)-5-oxopentanoic acid Traditional Name: 3-[[4-(4-cyanophenyl)phenyl]-ethyl-carbamoyl]-5-(hydroxyamino)-5-keto-valeric acid Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)C2=CC=C(C=C2)C#N)C(=O)C(CC(=O)NO)CC(=O)O

Isomeric SMILES

CCN(C1=CC=C(C=C1)C2=CC=C(C=C2)C#N)C(=O)C(CC(=O)NO)CC(=O)O

InChI

InChI=1S/C21H21N3O5/c1-2-24(21(28)17(12-20(26)27)11-19(25)23-29)18-9-7-16(8-10-18)15-5-3-14(13-22)4-6-15/h3-10,17,29H,2,11-12H2,1H3,(H,23,25)(H,26,27)