3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanamide

Systemtic Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanamide Openeye Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanamide CAS Name: 3-(3,5-dimethyl-4-nitro-1-pyrazolyl)-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-4-pyrazolyl]propanamide IUPAC Name: 3-(3,5-dimethyl-4-nitropyrazol-1-yl)-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethylpyrazol-4-yl]propanamide Traditional Name: 3-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-N-(1-m-anisyl-3,5-dimethyl-pyrazol-4-yl)propionamide Formula: C21H26N6O4 MolecularWeight: 426.46894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)OC)C)NC(=O)CCN3C(=C(C(=N3)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)OC)C)NC(=O)CCN3C(=C(C(=N3)C)[N+](=O)[O-])C

InChI

InChI=1S/C21H26N6O4/c1-13-20(15(3)26(23-13)12-17-7-6-8-18(11-17)31-5)22-19(28)9-10-25-16(4)21(27(29)30)14(2)24-25/h6-8,11H,9-10,12H2,1-5H3,(H,22,28)