(2S)-2,7-bis(azanyl)heptanoic acid; N'-oxidanyl-N-phenyl-octanediamide

Systemtic Name: (2S)-2,7-bis(azanyl)heptanoic acid; N'-oxidanyl-N-phenyl-octanediamide Openeye Name: (2S)-2,7-diaminoheptanoic acid; 8-(hydroxyamino)-8-oxo-N-phenyl-octanamide CAS Name: (2S)-2,7-diaminoheptanoic acid; N'-hydroxy-N-phenyloctanediamide IUPAC Name: (2S)-2,7-diaminoheptanoic acid; N'-hydroxy-N-phenyloctanediamide Traditional Name: (2S)-2,7-diaminoenanthic acid; 8-(hydroxyamino)-8-keto-N-phenyl-caprylamide Formula: C21H36N4O5 MolecularWeight: 424.53434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCCCCCC(=O)NO.C(CCC(C(=O)O)N)CCN

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCCCCCC(=O)NO.C(CC[C@@H](C(=O)O)N)CCN

InChI

InChI=1S/C14H20N2O3.C7H16N2O2/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19;8-5-3-1-2-4-6(9)7(10)11/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18);6H,1-5,8-9H2,(H,10,11)/t;6-/m.0/s1