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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N5O3/c1-15-19(16(2)26(24-15)18-10-6-5-7-11-18)14-25(4)17(3)22(28)23-20-12-8-9-13-21(20)27(29)30/h5-13,17H,14H2,1-4H3,(H,23,28)/t17-/m1/s1