3-[5-(3,4-dihydro-1H-isoquinolin-2-yl)pentyl]-1,2,3-benzotriazin-4-one hydrochloride

Systemtic Name: 3-[5-(3,4-dihydro-1H-isoquinolin-2-yl)pentyl]-1,2,3-benzotriazin-4-one hydrochloride Openeye Name: 3-[5-(3,4-dihydro-1H-isoquinolin-2-yl)pentyl]-1,2,3-benzotriazin-4-one hydrochloride CAS Name: 3-[5-(3,4-dihydro-1H-isoquinolin-2-yl)pentyl]-1,2,3-benzotriazin-4-one hydrochloride IUPAC Name: 3-[5-(3,4-dihydro-1H-isoquinolin-2-yl)pentyl]-1,2,3-benzotriazin-4-one hydrochloride Traditional Name: 3-[5-(3,4-dihydro-1H-isoquinolin-2-yl)pentyl]-1,2,3-benzotriazin-4-one hydrochloride Formula: C21H25ClN4O MolecularWeight: 384.9024

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCCCCN3C(=O)C4=CC=CC=C4N=N3.Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCCCCN3C(=O)C4=CC=CC=C4N=N3.Cl

InChI

InChI=1S/C21H24N4O.ClH/c26-21-19-10-4-5-11-20(19)22-23-25(21)14-7-1-6-13-24-15-12-17-8-2-3-9-18(17)16-24;/h2-5,8-11H,1,6-7,12-16H2;1H