N-[1-[(1-methylpyrazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide

Systemtic Name: N-[1-[(1-methylpyrazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]-3-nitro-benzamide Openeye Name: N-[1-methyl-2-[(1-methylpyrazol-3-yl)amino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[1-[(1-methyl-3-pyrazolyl)amino]-1-oxopropan-2-yl]-3-nitrobenzamide IUPAC Name: N-[1-[(1-methylpyrazol-3-yl)amino]-1-oxopropan-2-yl]-3-nitrobenzamide Traditional Name: N-[2-keto-1-methyl-2-[(1-methylpyrazol-3-yl)amino]ethyl]-3-nitro-benzamide Formula: C14H15N5O4 MolecularWeight: 317.3

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NN(C=C1)C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=NN(C=C1)C)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H15N5O4/c1-9(13(20)16-12-6-7-18(2)17-12)15-14(21)10-4-3-5-11(8-10)19(22)23/h3-9H,1-2H3,(H,15,21)(H,16,17,20)