3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-phenanthren-2-yl-propan-1-one hydrochloride

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-phenanthren-2-yl-propan-1-one hydrochloride Openeye Name: 3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-phenanthryl)propan-1-one hydrochloride CAS Name: 3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-phenanthrenyl)-1-propanone hydrochloride IUPAC Name: 3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-phenanthren-2-ylpropan-1-one hydrochloride Traditional Name: 3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(2-phenanthryl)propan-1-one hydrochloride Formula: C26H24ClNO MolecularWeight: 401.92786

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CCC(=O)C3=CC4=C(C=C3)C5=CC=CC=C5C=C4.Cl

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CCC(=O)C3=CC4=C(C=C3)C5=CC=CC=C5C=C4.Cl

InChI

InChI=1S/C26H23NO.ClH/c28-26(14-16-27-15-13-19-5-1-2-7-23(19)18-27)22-11-12-25-21(17-22)10-9-20-6-3-4-8-24(20)25;/h1-12,17H,13-16,18H2;1H