4-methyl-3-nitro-N-[2-oxidanylidene-2-(3-pyrazol-1-ylpropylamino)ethyl]benzamide

Systemtic Name: 4-methyl-3-nitro-N-[2-oxidanylidene-2-(3-pyrazol-1-ylpropylamino)ethyl]benzamide Openeye Name: 4-methyl-3-nitro-N-[2-oxo-2-(3-pyrazol-1-ylpropylamino)ethyl]benzamide CAS Name: 4-methyl-3-nitro-N-[2-oxo-2-[3-(1-pyrazolyl)propylamino]ethyl]benzamide IUPAC Name: 4-methyl-3-nitro-N-[2-oxo-2-(3-pyrazol-1-ylpropylamino)ethyl]benzamide Traditional Name: N-[2-keto-2-(3-pyrazol-1-ylpropylamino)ethyl]-4-methyl-3-nitro-benzamide Formula: C16H19N5O4 MolecularWeight: 345.35316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCC(=O)NCCCN2C=CC=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCC(=O)NCCCN2C=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O4/c1-12-4-5-13(10-14(12)21(24)25)16(23)18-11-15(22)17-6-2-8-20-9-3-7-19-20/h3-5,7,9-10H,2,6,8,11H2,1H3,(H,17,22)(H,18,23)