3,4-dihydro-1H-isoquinolin-2-yl-(1-ethylbenzotriazol-5-yl)methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-ethylbenzotriazol-5-yl)methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-ethylbenzotriazol-5-yl)methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-ethyl-5-benzotriazolyl)methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-ethylbenzotriazol-5-yl)methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-(1-ethylbenzotriazol-5-yl)methanone Formula: C18H18N4O MolecularWeight: 306.36172

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCC4=CC=CC=C4C3)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCC4=CC=CC=C4C3)N=N1

InChI

InChI=1S/C18H18N4O/c1-2-22-17-8-7-14(11-16(17)19-20-22)18(23)21-10-9-13-5-3-4-6-15(13)12-21/h3-8,11H,2,9-10,12H2,1H3