N-(2-morpholin-4-ium-4-ylethyl)-8-nitro-isoquinolin-5-amine

Systemtic Name: N-(2-morpholin-4-ium-4-ylethyl)-8-nitro-isoquinolin-5-amine Openeye Name: N-(2-morpholin-4-ium-4-ylethyl)-8-nitro-isoquinolin-5-amine CAS Name: N-[2-(4-morpholin-4-iumyl)ethyl]-8-nitro-5-isoquinolinamine IUPAC Name: N-(2-morpholin-4-ium-4-ylethyl)-8-nitroisoquinolin-5-amine Traditional Name: 2-morpholin-4-ium-4-ylethyl-(8-nitro-5-isoquinolyl)amine Formula: C15H19N4O3+ MolecularWeight: 303.33636

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCNC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CCNC2=C3C=CN=CC3=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H18N4O3/c20-19(21)15-2-1-14(12-3-4-16-11-13(12)15)17-5-6-18-7-9-22-10-8-18/h1-4,11,17H,5-10H2/p+1