(2S,3S)-5-methyl-3-[(2R)-2-methyl-4-quinolin-3-yl-piperazin-1-yl]carbonyl-N,2-bis(oxidanyl)hexanamide

Systemtic Name: (2S,3S)-5-methyl-3-[(2R)-2-methyl-4-quinolin-3-yl-piperazin-1-yl]carbonyl-N,2-bis(oxidanyl)hexanamide Openeye Name: (2S,3S)-2-hydroxy-5-methyl-3-[(2R)-2-methyl-4-(3-quinolyl)piperazine-1-carbonyl]hexanehydroxamic acid CAS Name: (2S,3S)-N,2-dihydroxy-5-methyl-3-[[(2R)-2-methyl-4-(3-quinolinyl)-1-piperazinyl]-oxomethyl]hexanamide IUPAC Name: (2S,3S)-N,2-dihydroxy-5-methyl-3-[(2R)-2-methyl-4-quinolin-3-ylpiperazine-1-carbonyl]hexanamide Traditional Name: (2S,3S)-2-hydroxy-5-methyl-3-[(2R)-2-methyl-4-(3-quinolyl)piperazine-1-carbonyl]hexanehydroxamic acid Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C(CC(C)C)C(C(=O)NO)O)C2=CC3=CC=CC=C3N=C2

Isomeric SMILES

C[C@@H]1CN(CCN1C(=O)[C@@H](CC(C)C)[C@@H](C(=O)NO)O)C2=CC3=CC=CC=C3N=C2

InChI

InChI=1S/C22H30N4O4/c1-14(2)10-18(20(27)21(28)24-30)22(29)26-9-8-25(13-15(26)3)17-11-16-6-4-5-7-19(16)23-12-17/h4-7,11-12,14-15,18,20,27,30H,8-10,13H2,1-3H3,(H,24,28)/t15-,18+,20+/m1/s1