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

Systemtic Name: 3-(4-bromanyl-3-nitro-pyrazol-1-yl)-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanamide Openeye Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]propanamide CAS Name: 3-(4-bromo-3-nitro-1-pyrazolyl)-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethyl-4-pyrazolyl]propanamide IUPAC Name: 3-(4-bromo-3-nitropyrazol-1-yl)-N-[1-[(3-methoxyphenyl)methyl]-3,5-dimethylpyrazol-4-yl]propanamide Traditional Name: 3-(4-bromo-3-nitro-pyrazol-1-yl)-N-(1-m-anisyl-3,5-dimethyl-pyrazol-4-yl)propionamide Formula: C19H21BrN6O4 MolecularWeight: 477.31184

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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)[N+](=O)[O-])Br

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrN6O4/c1-12-18(13(2)25(22-12)10-14-5-4-6-15(9-14)30-3)21-17(27)7-8-24-11-16(20)19(23-24)26(28)29/h4-6,9,11H,7-8,10H2,1-3H3,(H,21,27)