2-methyl-4-[2-(4-nitrophenyl)ethanoylamino]-5-propyl-pyrazole-3-carboxamide

Systemtic Name: 2-methyl-4-[2-(4-nitrophenyl)ethanoylamino]-5-propyl-pyrazole-3-carboxamide Openeye Name: 2-methyl-4-[[2-(4-nitrophenyl)acetyl]amino]-5-propyl-pyrazole-3-carboxamide CAS Name: 2-methyl-4-[[2-(4-nitrophenyl)-1-oxoethyl]amino]-5-propyl-3-pyrazolecarboxamide IUPAC Name: 2-methyl-4-[[2-(4-nitrophenyl)acetyl]amino]-5-propylpyrazole-3-carboxamide Traditional Name: 2-methyl-4-[[2-(4-nitrophenyl)acetyl]amino]-5-propyl-pyrazole-3-carboxamide Formula: C16H19N5O4 MolecularWeight: 345.35316

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)N)C

Isomeric SMILES

CCCC1=NN(C(=C1NC(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)N)C

InChI

InChI=1S/C16H19N5O4/c1-3-4-12-14(15(16(17)23)20(2)19-12)18-13(22)9-10-5-7-11(8-6-10)21(24)25/h5-8H,3-4,9H2,1-2H3,(H2,17,23)(H,18,22)