1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine

Systemtic Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine Openeye Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine CAS Name: 1-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine IUPAC Name: 1-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine Traditional Name: 1-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-4-(2,3,4-trimethoxybenzyl)piperazine Formula: C20H29N5O5 MolecularWeight: 419.47476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CN2CCN(CC2)CC3=C(C(=C(C=C3)OC)OC)OC)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CN2CCN(CC2)CC3=C(C(=C(C=C3)OC)OC)OC)C)[N+](=O)[O-]

InChI

InChI=1S/C20H29N5O5/c1-14-18(25(26)27)15(2)24(21-14)13-23-10-8-22(9-11-23)12-16-6-7-17(28-3)20(30-5)19(16)29-4/h6-7H,8-13H2,1-5H3