4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-methyl-2-morpholin-4-yl-propyl)benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-methyl-2-morpholin-4-yl-propyl)benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-methyl-2-morpholino-propyl)benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[2-methyl-2-(4-morpholinyl)propyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-(2-methyl-2-morpholin-4-ylpropyl)benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-(2-methyl-2-morpholino-propyl)benzamide Formula: C21H29N5O4 MolecularWeight: 415.48606

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC(C)(C)N3CCOCC3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NCC(C)(C)N3CCOCC3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H29N5O4/c1-15-19(26(28)29)16(2)25(23-15)13-17-5-7-18(8-6-17)20(27)22-14-21(3,4)24-9-11-30-12-10-24/h5-8H,9-14H2,1-4H3,(H,22,27)