1-[[3,5-bis(4-methoxyphenyl)pyrazol-1-yl]methyl]-5-methyl-3-nitro-pyrazole

Systemtic Name: 1-[[3,5-bis(4-methoxyphenyl)pyrazol-1-yl]methyl]-5-methyl-3-nitro-pyrazole Openeye Name: 1-[[3,5-bis(4-methoxyphenyl)pyrazol-1-yl]methyl]-5-methyl-3-nitro-pyrazole CAS Name: 1-[[3,5-bis(4-methoxyphenyl)-1-pyrazolyl]methyl]-5-methyl-3-nitropyrazole IUPAC Name: 1-[[3,5-bis(4-methoxyphenyl)pyrazol-1-yl]methyl]-5-methyl-3-nitropyrazole Traditional Name: 1-[[3,5-bis(4-methoxyphenyl)pyrazol-1-yl]methyl]-5-methyl-3-nitro-pyrazole Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CN2C(=CC(=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NN1CN2C(=CC(=N2)C3=CC=C(C=C3)OC)C4=CC=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O4/c1-15-12-22(27(28)29)24-25(15)14-26-21(17-6-10-19(31-3)11-7-17)13-20(23-26)16-4-8-18(30-2)9-5-16/h4-13H,14H2,1-3H3