N-(1-methylsulfonylpiperidin-4-yl)-8-nitro-isoquinolin-5-amine

Systemtic Name: N-(1-methylsulfonylpiperidin-4-yl)-8-nitro-isoquinolin-5-amine Openeye Name: N-(1-methylsulfonyl-4-piperidyl)-8-nitro-isoquinolin-5-amine CAS Name: N-(1-methylsulfonyl-4-piperidinyl)-8-nitro-5-isoquinolinamine IUPAC Name: N-(1-methylsulfonylpiperidin-4-yl)-8-nitroisoquinolin-5-amine Traditional Name: (1-mesyl-4-piperidyl)-(8-nitro-5-isoquinolyl)amine Formula: C15H18N4O4S MolecularWeight: 350.39282

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCC(CC1)NC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)N1CCC(CC1)NC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O4S/c1-24(22,23)18-8-5-11(6-9-18)17-14-2-3-15(19(20)21)13-10-16-7-4-12(13)14/h2-4,7,10-11,17H,5-6,8-9H2,1H3