N-(3-methoxypropyl)-5-(1-methylpyrrol-2-yl)-2-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-(3-methoxypropyl)-5-(1-methylpyrrol-2-yl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-(3-methoxypropyl)-5-(1-methylpyrrol-2-yl)-2-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-(3-methoxypropyl)-5-(1-methyl-2-pyrrolyl)-2-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-(3-methoxypropyl)-5-(1-methylpyrrol-2-yl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-(3-methoxypropyl)-5-(1-methylpyrrol-2-yl)-2-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C19H21N5O4 MolecularWeight: 383.40114

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C2=NN(C(=C2)C(=O)NCCCOC)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC=C1C2=NN(C(=C2)C(=O)NCCCOC)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O4/c1-22-10-4-8-17(22)16-13-18(19(25)20-9-5-11-28-2)23(21-16)14-6-3-7-15(12-14)24(26)27/h3-4,6-8,10,12-13H,5,9,11H2,1-2H3,(H,20,25)