cyclopentyl-[5-nitro-2-(phenylmethyl)pyrazol-3-yl]methanone

Systemtic Name: cyclopentyl-[5-nitro-2-(phenylmethyl)pyrazol-3-yl]methanone Openeye Name: (2-benzyl-5-nitro-pyrazol-3-yl)-cyclopentyl-methanone CAS Name: cyclopentyl-[5-nitro-2-(phenylmethyl)-3-pyrazolyl]methanone IUPAC Name: (2-benzyl-5-nitropyrazol-3-yl)-cyclopentylmethanone Traditional Name: (2-benzyl-5-nitro-pyrazol-3-yl)-cyclopentyl-methanone Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)C2=CC(=NN2CC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)C(=O)C2=CC(=NN2CC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O3/c20-16(13-8-4-5-9-13)14-10-15(19(21)22)17-18(14)11-12-6-2-1-3-7-12/h1-3,6-7,10,13H,4-5,8-9,11H2