4-[2-(ethylamino)ethanoyl]-2-(4-nitrophenyl)-5-propan-2-yl-1H-pyrazol-3-one

Systemtic Name: 4-[2-(ethylamino)ethanoyl]-2-(4-nitrophenyl)-5-propan-2-yl-1H-pyrazol-3-one Openeye Name: 4-[2-(ethylamino)acetyl]-5-isopropyl-2-(4-nitrophenyl)-1H-pyrazol-3-one CAS Name: 4-[2-(ethylamino)-1-oxoethyl]-2-(4-nitrophenyl)-5-propan-2-yl-1H-pyrazol-3-one IUPAC Name: 4-[2-(ethylamino)acetyl]-2-(4-nitrophenyl)-5-propan-2-yl-1H-pyrazol-3-one Traditional Name: 4-[2-(ethylamino)acetyl]-5-isopropyl-2-(4-nitrophenyl)-3-pyrazolin-3-one Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC(=O)C1=C(NN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

Isomeric SMILES

CCNCC(=O)C1=C(NN(C1=O)C2=CC=C(C=C2)[N+](=O)[O-])C(C)C

InChI

InChI=1S/C16H20N4O4/c1-4-17-9-13(21)14-15(10(2)3)18-19(16(14)22)11-5-7-12(8-6-11)20(23)24/h5-8,10,17-18H,4,9H2,1-3H3