2-(benzotriazol-1-yl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]ethanamide

Systemtic Name: 2-(benzotriazol-1-yl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]ethanamide Openeye Name: 2-(benzotriazol-1-yl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]acetamide CAS Name: 2-(1-benzotriazolyl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]acetamide IUPAC Name: 2-(benzotriazol-1-yl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]acetamide Traditional Name: 2-(benzotriazol-1-yl)-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]acetamide Formula: C21H25N5O MolecularWeight: 363.4561

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)CN1C2=CC=CC=C2N=N1)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC(CNC(=O)CN1C2=CC=CC=C2N=N1)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H25N5O/c1-2-18(25-12-11-16-7-3-4-8-17(16)14-25)13-22-21(27)15-26-20-10-6-5-9-19(20)23-24-26/h3-10,18H,2,11-15H2,1H3,(H,22,27)