3-chloranyl-1-(4-methylpiperazin-1-yl)-5-nitro-isoquinoline

Systemtic Name: 3-chloranyl-1-(4-methylpiperazin-1-yl)-5-nitro-isoquinoline Openeye Name: 3-chloro-1-(4-methylpiperazin-1-yl)-5-nitro-isoquinoline CAS Name: 3-chloro-1-(4-methyl-1-piperazinyl)-5-nitroisoquinoline IUPAC Name: 3-chloro-1-(4-methylpiperazin-1-yl)-5-nitroisoquinoline Traditional Name: 3-chloro-1-(4-methylpiperazino)-5-nitro-isoquinoline Formula: C14H15ClN4O2 MolecularWeight: 306.7475

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C3C=CC=C(C3=CC(=N2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C3C=CC=C(C3=CC(=N2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H15ClN4O2/c1-17-5-7-18(8-6-17)14-10-3-2-4-12(19(20)21)11(10)9-13(15)16-14/h2-4,9H,5-8H2,1H3