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

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-5-morpholin-4-yl-2-nitro-benzamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-5-morpholino-2-nitro-benzamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-5-(4-morpholinyl)-2-nitrobenzamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-5-morpholin-4-yl-2-nitrobenzamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-5-morpholino-2-nitro-benzamide Formula: C19H25N5O4 MolecularWeight: 387.4329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C2=C(C=CC(=C2)N3CCOCC3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C2=C(C=CC(=C2)N3CCOCC3)[N+](=O)[O-])C

InChI

InChI=1S/C19H25N5O4/c1-14-12-15(2)23(21-14)7-3-6-20-19(25)17-13-16(4-5-18(17)24(26)27)22-8-10-28-11-9-22/h4-5,12-13H,3,6-11H2,1-2H3,(H,20,25)