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

Systemtic Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-N-(2-methyl-4-nitro-phenyl)ethanamide Openeye Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-N-(2-methyl-4-nitro-phenyl)acetamide CAS Name: 2-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-methylamino]-N-(2-methyl-4-nitrophenyl)acetamide IUPAC Name: 2-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methylamino]-N-(2-methyl-4-nitrophenyl)acetamide Traditional Name: 2-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]-N-(2-methyl-4-nitro-phenyl)acetamide Formula: C22H25N5O3 MolecularWeight: 407.4656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CN(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)CN(C)CC2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C22H25N5O3/c1-15-12-19(27(29)30)10-11-21(15)23-22(28)14-25(4)13-20-16(2)24-26(17(20)3)18-8-6-5-7-9-18/h5-12H,13-14H2,1-4H3,(H,23,28)