(1-azanylisoquinolin-6-yl)methoxycarbonyl-(2-morpholin-4-ylethyl)-oxidanylidene-azanium

Systemtic Name: (1-azanylisoquinolin-6-yl)methoxycarbonyl-(2-morpholin-4-ylethyl)-oxidanylidene-azanium Openeye Name: (1-amino-6-isoquinolyl)methoxycarbonyl-(2-morpholinoethyl)-oxo-ammonium CAS Name: [(1-amino-6-isoquinolinyl)methoxy-oxomethyl]-[2-(4-morpholinyl)ethyl]-oxoammonium IUPAC Name: (1-aminoisoquinolin-6-yl)methoxycarbonyl-(2-morpholin-4-ylethyl)-oxoazanium Traditional Name: (1-amino-6-isoquinolyl)methoxycarbonyl-keto-(2-morpholinoethyl)ammonium Formula: C17H21N4O4+ MolecularWeight: 345.37304

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC[N+](=O)C(=O)OCC2=CC3=C(C=C2)C(=NC=C3)N

Isomeric SMILES

C1COCCN1CC[N+](=O)C(=O)OCC2=CC3=C(C=C2)C(=NC=C3)N

InChI

InChI=1S/C17H21N4O4/c18-16-15-2-1-13(11-14(15)3-4-19-16)12-25-17(22)21(23)6-5-20-7-9-24-10-8-20/h1-4,11H,5-10,12H2,(H2,18,19)/q+1