3-[2-[4-(4-cyanophenyl)phenyl]ethylcarbamoyl]-5-(oxidanylamino)-5-oxidanylidene-pentanoic acid

Systemtic Name: 3-[2-[4-(4-cyanophenyl)phenyl]ethylcarbamoyl]-5-(oxidanylamino)-5-oxidanylidene-pentanoic acid Openeye Name: 3-[2-[4-(4-cyanophenyl)phenyl]ethylcarbamoyl]-5-(hydroxyamino)-5-oxo-pentanoic acid CAS Name: 3-[[2-[4-(4-cyanophenyl)phenyl]ethylamino]-oxomethyl]-5-(hydroxyamino)-5-oxopentanoic acid IUPAC Name: 3-[2-[4-(4-cyanophenyl)phenyl]ethylcarbamoyl]-5-(hydroxyamino)-5-oxopentanoic acid Traditional Name: 3-[2-[4-(4-cyanophenyl)phenyl]ethylcarbamoyl]-5-(hydroxyamino)-5-keto-valeric acid Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)C(CC(=O)NO)CC(=O)O)C2=CC=C(C=C2)C#N

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)C(CC(=O)NO)CC(=O)O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C21H21N3O5/c22-13-15-3-7-17(8-4-15)16-5-1-14(2-6-16)9-10-23-21(28)18(12-20(26)27)11-19(25)24-29/h1-8,18,29H,9-12H2,(H,23,28)(H,24,25)(H,26,27)