4-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]-N,N-diethyl-benzamide

Systemtic Name: 4-[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)ethanoylamino]-N,N-diethyl-benzamide Openeye Name: 4-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]-N,N-diethyl-benzamide CAS Name: 4-[[2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-oxoethyl]amino]-N,N-diethylbenzamide IUPAC Name: 4-[[2-(3,5-dimethyl-4-nitropyrazol-1-yl)acetyl]amino]-N,N-diethylbenzamide Traditional Name: 4-[[2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)acetyl]amino]-N,N-diethyl-benzamide Formula: C18H23N5O4 MolecularWeight: 373.40632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CN2C(=C(C(=N2)C)[N+](=O)[O-])C

InChI

InChI=1S/C18H23N5O4/c1-5-21(6-2)18(25)14-7-9-15(10-8-14)19-16(24)11-22-13(4)17(23(26)27)12(3)20-22/h7-10H,5-6,11H2,1-4H3,(H,19,24)