N-[2-[methyl-[(1-phenylpyrazol-4-yl)methyl]amino]-2-oxidanylidene-ethyl]-3-nitro-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)CNC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H19N5O4/c1-23(13-15-11-22-24(14-15)17-7-3-2-4-8-17)19(26)12-21-20(27)16-6-5-9-18(10-16)25(28)29/h2-11,14H,12-13H2,1H3,(H,21,27)