N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide

Systemtic Name: N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Openeye Name: N-[2-(cyclopropylamino)-2-oxo-ethyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide CAS Name: N-[2-(cyclopropylamino)-2-oxoethyl]-4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]benzamide IUPAC Name: N-[2-(cyclopropylamino)-2-oxoethyl]-4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N-[2-(cyclopropylamino)-2-keto-ethyl]-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Formula: C18H21N5O4 MolecularWeight: 371.39044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC(=O)NC3CC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC(=O)NC3CC3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H21N5O4/c1-11-17(23(26)27)12(2)22(21-11)10-13-3-5-14(6-4-13)18(25)19-9-16(24)20-15-7-8-15/h3-6,15H,7-10H2,1-2H3,(H,19,25)(H,20,24)