4-(hydroxymethyl)-5-(3-nitrophenyl)-3-piperazin-1-yl-4,5-dihydro-1H-pyridazin-6-one

Systemtic Name: 4-(hydroxymethyl)-5-(3-nitrophenyl)-3-piperazin-1-yl-4,5-dihydro-1H-pyridazin-6-one Openeye Name: 4-(hydroxymethyl)-5-(3-nitrophenyl)-3-piperazin-1-yl-4,5-dihydro-1H-pyridazin-6-one CAS Name: 4-(hydroxymethyl)-5-(3-nitrophenyl)-3-(1-piperazinyl)-4,5-dihydro-1H-pyridazin-6-one IUPAC Name: 4-(hydroxymethyl)-5-(3-nitrophenyl)-3-piperazin-1-yl-4,5-dihydro-1H-pyridazin-6-one Traditional Name: 4-methylol-5-(3-nitrophenyl)-3-piperazino-4,5-dihydro-1H-pyridazin-6-one Formula: C15H19N5O4 MolecularWeight: 333.34246

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=NNC(=O)C(C2CO)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1)C2=NNC(=O)C(C2CO)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H19N5O4/c21-9-12-13(10-2-1-3-11(8-10)20(23)24)15(22)18-17-14(12)19-6-4-16-5-7-19/h1-3,8,12-13,16,21H,4-7,9H2,(H,18,22)