5-(isoquinolin-1-ylamino)pentan-1-ol nitrate

Systemtic Name: 5-(isoquinolin-1-ylamino)pentan-1-ol nitrate Openeye Name: 5-(1-isoquinolylamino)pentan-1-ol nitrate CAS Name: 5-(1-isoquinolinylamino)-1-pentanol nitrate IUPAC Name: 5-(isoquinolin-1-ylamino)pentan-1-ol nitrate Traditional Name: 5-(1-isoquinolylamino)pentan-1-ol nitrate Formula: C14H18N3O4- MolecularWeight: 292.31042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN=C2NCCCCCO.[N+](=O)([O-])[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CN=C2NCCCCCO.[N+](=O)([O-])[O-]

InChI

InChI=1S/C14H18N2O.NO3/c17-11-5-1-4-9-15-14-13-7-3-2-6-12(13)8-10-16-14;2-1(3)4/h2-3,6-8,10,17H,1,4-5,9,11H2,(H,15,16);/q;-1