4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[1-(phenylmethyl)pyrrolidin-3-yl]benzamide Openeye Name: N-(1-benzylpyrrolidin-3-yl)-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[1-(phenylmethyl)-3-pyrrolidinyl]benzamide IUPAC Name: N-(1-benzylpyrrolidin-3-yl)-4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N-(1-benzylpyrrolidin-3-yl)-4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Formula: C24H27N5O3 MolecularWeight: 433.50288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3CCN(C3)CC4=CC=CC=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3CCN(C3)CC4=CC=CC=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C24H27N5O3/c1-17-23(29(31)32)18(2)28(26-17)15-20-8-10-21(11-9-20)24(30)25-22-12-13-27(16-22)14-19-6-4-3-5-7-19/h3-11,22H,12-16H2,1-2H3,(H,25,30)