2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]butanamide

Systemtic Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]butanamide Openeye Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(morpholinomethyl)phenyl]butanamide CAS Name: 2-(5-methyl-3-nitro-1-pyrazolyl)-N-[3-(4-morpholinylmethyl)phenyl]butanamide IUPAC Name: 2-(5-methyl-3-nitropyrazol-1-yl)-N-[3-(morpholin-4-ylmethyl)phenyl]butanamide Traditional Name: 2-(5-methyl-3-nitro-pyrazol-1-yl)-N-[3-(morpholinomethyl)phenyl]butyramide Formula: C19H25N5O4 MolecularWeight: 387.4329

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)CN2CCOCC2)N3C(=CC(=N3)[N+](=O)[O-])C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)CN2CCOCC2)N3C(=CC(=N3)[N+](=O)[O-])C

InChI

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