2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]butanamide

Systemtic Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]butanamide Openeye Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-(1-naphthylmethyl)pyrazol-4-yl]butanamide CAS Name: 2-(5-methyl-3-nitro-1-pyrazolyl)-N-[1-(1-naphthalenylmethyl)-4-pyrazolyl]butanamide IUPAC Name: 2-(5-methyl-3-nitropyrazol-1-yl)-N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]butanamide Traditional Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[1-(1-naphthylmethyl)pyrazol-4-yl]butyramide Formula: C22H22N6O3 MolecularWeight: 418.44848

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CN(N=C1)CC2=CC=CC3=CC=CC=C32)N4C(=CC(=N4)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NC1=CN(N=C1)CC2=CC=CC3=CC=CC=C32)N4C(=CC(=N4)[N+](=O)[O-])C

InChI

InChI=1S/C22H22N6O3/c1-3-20(27-15(2)11-21(25-27)28(30)31)22(29)24-18-12-23-26(14-18)13-17-9-6-8-16-7-4-5-10-19(16)17/h4-12,14,20H,3,13H2,1-2H3,(H,24,29)