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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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