3-bromanyl-4-ethoxy-N-(1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)benzamide

Systemtic Name: 3-bromanyl-4-ethoxy-N-(1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)benzamide Openeye Name: 3-bromo-4-ethoxy-N-(1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)benzamide CAS Name: 3-bromo-4-ethoxy-N-(1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)benzamide IUPAC Name: 3-bromo-4-ethoxy-N-(1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)benzamide Traditional Name: 3-bromo-4-ethoxy-N-(1,1,2-trimethyl-3,4-dihydroisoquinolin-7-yl)benzamide Formula: C21H25BrN2O2 MolecularWeight: 417.3394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(CCN(C3(C)C)C)C=C2)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(CCN(C3(C)C)C)C=C2)Br

InChI

InChI=1S/C21H25BrN2O2/c1-5-26-19-9-7-15(12-18(19)22)20(25)23-16-8-6-14-10-11-24(4)21(2,3)17(14)13-16/h6-9,12-13H,5,10-11H2,1-4H3,(H,23,25)