3-bromanyl-N-(5-chloranyl-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-ethyl-benzamide

Systemtic Name: 3-bromanyl-N-(5-chloranyl-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-ethyl-benzamide Openeye Name: 3-bromo-N-(5-chloro-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-ethyl-benzamide CAS Name: 3-bromo-N-(5-chloro-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-ethylbenzamide IUPAC Name: 3-bromo-N-(5-chloro-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-ethylbenzamide Traditional Name: 3-bromo-N-(5-chloro-1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)-4-ethyl-benzamide Formula: C21H24BrClN2O MolecularWeight: 435.78506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(=O)NC2=CC(=C3CCN(C(C3=C2)(C)C)C)Cl)Br

Isomeric SMILES

CCC1=C(C=C(C=C1)C(=O)NC2=CC(=C3CCN(C(C3=C2)(C)C)C)Cl)Br

InChI

InChI=1S/C21H24BrClN2O/c1-5-13-6-7-14(10-18(13)22)20(26)24-15-11-17-16(19(23)12-15)8-9-25(4)21(17,2)3/h6-7,10-12H,5,8-9H2,1-4H3,(H,24,26)