5-methyl-2-(4-nitrophenyl)-4-[1-(2-piperazin-1-ylethylamino)ethylidene]pyrazol-3-one

Systemtic Name: 5-methyl-2-(4-nitrophenyl)-4-[1-(2-piperazin-1-ylethylamino)ethylidene]pyrazol-3-one Openeye Name: 5-methyl-2-(4-nitrophenyl)-4-[1-(2-piperazin-1-ylethylamino)ethylidene]pyrazol-3-one CAS Name: 5-methyl-2-(4-nitrophenyl)-4-[1-[2-(1-piperazinyl)ethylamino]ethylidene]-3-pyrazolone IUPAC Name: 5-methyl-2-(4-nitrophenyl)-4-[1-(2-piperazin-1-ylethylamino)ethylidene]pyrazol-3-one Traditional Name: 5-methyl-2-(4-nitrophenyl)-4-[1-(2-piperazinoethylamino)ethylidene]-2-pyrazolin-3-one Formula: C18H24N6O3 MolecularWeight: 372.42156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=C(C)NCCN2CCNCC2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(=O)C1=C(C)NCCN2CCNCC2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H24N6O3/c1-13(20-9-12-22-10-7-19-8-11-22)17-14(2)21-23(18(17)25)15-3-5-16(6-4-15)24(26)27/h3-6,19-20H,7-12H2,1-2H3