N-[(2S)-butan-2-yl]-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[(2S)-butan-2-yl]-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-N-[(1S)-1-methylpropyl]-3-nitro-benzamide CAS Name: N-[(2S)-butan-2-yl]-N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[(2S)-butan-2-yl]-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]-N-[(1S)-1-methylpropyl]-3-nitro-benzamide Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)NC1=NOC(=C1)C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC[C@H](C)N(CC(=O)NC1=NOC(=C1)C)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O5/c1-4-11(2)20(10-16(22)18-15-8-12(3)26-19-15)17(23)13-6-5-7-14(9-13)21(24)25/h5-9,11H,4,10H2,1-3H3,(H,18,19,22)/t11-/m0/s1