(2S)-2-[(4-dimethylaminophenyl)carbonylamino]-N'-oxidanyl-N-quinolin-8-yl-octanediamide

Systemtic Name: (2S)-2-[(4-dimethylaminophenyl)carbonylamino]-N'-oxidanyl-N-quinolin-8-yl-octanediamide Openeye Name: 4-(dimethylamino)-N-[(1S)-7-(hydroxyamino)-7-oxo-1-(8-quinolylcarbamoyl)heptyl]benzamide CAS Name: (2S)-2-[[(4-dimethylaminophenyl)-oxomethyl]amino]-N'-hydroxy-N-(8-quinolinyl)octanediamide IUPAC Name: (2S)-2-[[4-(dimethylamino)benzoyl]amino]-N'-hydroxy-N-quinolin-8-yloctanediamide Traditional Name: 4-(dimethylamino)-N-[(1S)-7-(hydroxyamino)-7-keto-1-(8-quinolylcarbamoyl)heptyl]benzamide Formula: C26H31N5O4 MolecularWeight: 477.55544

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(=O)NC(CCCCCC(=O)NO)C(=O)NC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(=O)N[C@@H](CCCCCC(=O)NO)C(=O)NC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C26H31N5O4/c1-31(2)20-15-13-19(14-16-20)25(33)29-22(10-4-3-5-12-23(32)30-35)26(34)28-21-11-6-8-18-9-7-17-27-24(18)21/h6-9,11,13-17,22,35H,3-5,10,12H2,1-2H3,(H,28,34)(H,29,33)(H,30,32)/t22-/m0/s1