5-nitro-1-(5-piperidin-1-ylpentyl)-2H-indazol-3-one

Systemtic Name: 5-nitro-1-(5-piperidin-1-ylpentyl)-2H-indazol-3-one Openeye Name: 5-nitro-1-[5-(1-piperidyl)pentyl]-2H-indazol-3-one CAS Name: 5-nitro-1-[5-(1-piperidinyl)pentyl]-2H-indazol-3-one IUPAC Name: 5-nitro-1-(5-piperidin-1-ylpentyl)-2H-indazol-3-one Traditional Name: 5-nitro-1-(5-piperidinopentyl)indazolin-3-one Formula: C17H24N4O3 MolecularWeight: 332.39746

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCCCN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2

Isomeric SMILES

C1CCN(CC1)CCCCCN2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2

InChI

InChI=1S/C17H24N4O3/c22-17-15-13-14(21(23)24)7-8-16(15)20(18-17)12-6-2-5-11-19-9-3-1-4-10-19/h7-8,13H,1-6,9-12H2,(H,18,22)