5-(1-methylpyrrol-2-yl)-2-(4-nitrophenyl)-N,N-dipropyl-pyrazole-3-carboxamide

Systemtic Name: 5-(1-methylpyrrol-2-yl)-2-(4-nitrophenyl)-N,N-dipropyl-pyrazole-3-carboxamide Openeye Name: 5-(1-methylpyrrol-2-yl)-2-(4-nitrophenyl)-N,N-dipropyl-pyrazole-3-carboxamide CAS Name: 5-(1-methyl-2-pyrrolyl)-2-(4-nitrophenyl)-N,N-dipropyl-3-pyrazolecarboxamide IUPAC Name: 5-(1-methylpyrrol-2-yl)-2-(4-nitrophenyl)-N,N-dipropylpyrazole-3-carboxamide Traditional Name: 5-(1-methylpyrrol-2-yl)-2-(4-nitrophenyl)-N,N-dipropyl-pyrazole-3-carboxamide Formula: C21H25N5O3 MolecularWeight: 395.4549

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CN3C

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CN3C

InChI

InChI=1S/C21H25N5O3/c1-4-12-24(13-5-2)21(27)20-15-18(19-7-6-14-23(19)3)22-25(20)16-8-10-17(11-9-16)26(28)29/h6-11,14-15H,4-5,12-13H2,1-3H3