N-[2-[[4-(3,5-dimethylpyrazol-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[[4-(3,5-dimethylpyrazol-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-[4-(3,5-dimethylpyrazol-1-yl)anilino]-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-[4-(3,5-dimethyl-1-pyrazolyl)anilino]-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-[4-(3,5-dimethylpyrazol-1-yl)anilino]-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-[4-(3,5-dimethylpyrazol-1-yl)anilino]-2-keto-ethyl]-3-nitro-benzamide Formula: C20H19N5O4 MolecularWeight: 393.39596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC=C(C=C2)NC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1C2=CC=C(C=C2)NC(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C20H19N5O4/c1-13-10-14(2)24(23-13)17-8-6-16(7-9-17)22-19(26)12-21-20(27)15-4-3-5-18(11-15)25(28)29/h3-11H,12H2,1-2H3,(H,21,27)(H,22,26)