2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-N-(2-nitrophenyl)ethanamide

Systemtic Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-N-(2-nitrophenyl)ethanamide Openeye Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-N-(2-nitrophenyl)acetamide CAS Name: 2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-methylamino]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methylamino]-N-(2-nitrophenyl)acetamide Traditional Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-N-(2-nitrophenyl)acetamide Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CC(=O)NC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CC(=O)NC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C21H23N5O3/c1-15-18(16(2)25(23-15)17-9-5-4-6-10-17)13-24(3)14-21(27)22-19-11-7-8-12-20(19)26(28)29/h4-12H,13-14H2,1-3H3,(H,22,27)