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

Systemtic Name: 3-chloranyl-4-ethoxy-N-(2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)benzamide Openeye Name: 3-chloro-4-ethoxy-N-(2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)benzamide CAS Name: 3-chloro-4-ethoxy-N-(2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)benzamide IUPAC Name: 3-chloro-4-ethoxy-N-(2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)benzamide Traditional Name: 3-chloro-4-ethoxy-N-(2,4,4-trimethyl-1,3-dihydroisoquinolin-7-yl)benzamide Formula: C21H25ClN2O2 MolecularWeight: 372.8884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(CN(C3)C)(C)C)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)C(CN(C3)C)(C)C)Cl

InChI

InChI=1S/C21H25ClN2O2/c1-5-26-19-9-6-14(11-18(19)22)20(25)23-16-7-8-17-15(10-16)12-24(4)13-21(17,2)3/h6-11H,5,12-13H2,1-4H3,(H,23,25)