8-nitro-5-[4-(pyridin-3-ylmethyl)piperazin-1-yl]isoquinoline

Systemtic Name: 8-nitro-5-[4-(pyridin-3-ylmethyl)piperazin-1-yl]isoquinoline Openeye Name: 8-nitro-5-[4-(3-pyridylmethyl)piperazin-1-yl]isoquinoline CAS Name: 8-nitro-5-[4-(3-pyridinylmethyl)-1-piperazinyl]isoquinoline IUPAC Name: 8-nitro-5-[4-(pyridin-3-ylmethyl)piperazin-1-yl]isoquinoline Traditional Name: 8-nitro-5-[4-(3-pyridylmethyl)piperazino]isoquinoline Formula: C19H19N5O2 MolecularWeight: 349.38646

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CN=CC=C2)C3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CN=CC=C2)C3=C4C=CN=CC4=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O2/c25-24(26)19-4-3-18(16-5-7-21-13-17(16)19)23-10-8-22(9-11-23)14-15-2-1-6-20-12-15/h1-7,12-13H,8-11,14H2