(1-aminocarbonylisoquinolin-7-yl)oxy-oxidanidyl-oxidanylidene-phosphanium; butane

Systemtic Name: (1-aminocarbonylisoquinolin-7-yl)oxy-oxidanidyl-oxidanylidene-phosphanium; butane Openeye Name: butane; (1-carbamoyl-7-isoquinolyl)oxy-oxido-oxo-phosphonium CAS Name: butane; (1-carbamoyl-7-isoquinolinyl)oxy-oxido-oxophosphonium IUPAC Name: butane; (1-carbamoylisoquinolin-7-yl)oxy-oxido-oxophosphanium Traditional Name: (1-carbamoyl-7-isoquinolyl)oxy-keto-oxido-phosphonium; n-butane Formula: C14H17N2O4P MolecularWeight: 308.269541

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Descriptors Computed from Structure

Canonical SMILES:

CCCC.C1=CC(=CC2=C1C=CN=C2C(=O)N)O[P+](=O)[O-]

Isomeric SMILES

CCCC.C1=CC(=CC2=C1C=CN=C2C(=O)N)O[P+](=O)[O-]

InChI

InChI=1S/C10H7N2O4P.C4H10/c11-10(13)9-8-5-7(16-17(14)15)2-1-6(8)3-4-12-9;1-3-4-2/h1-5H,(H2,11,13);3-4H2,1-2H3