2-(4-chloranylphenoxy)-2-methyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)propanamide

Systemtic Name: 2-(4-chloranylphenoxy)-2-methyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)propanamide Openeye Name: 2-(4-chlorophenoxy)-2-methyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)propanamide CAS Name: 2-(4-chlorophenoxy)-2-methyl-N-[2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]propanamide IUPAC Name: 2-(4-chlorophenoxy)-2-methyl-N-(2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)propanamide Traditional Name: 2-(4-chlorophenoxy)-2-methyl-N-(2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)propionamide Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C(C)(C)OC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(=O)N1CCC2=C(C1)C=C(C=C2)NC(=O)C(C)(C)OC3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H25ClN2O3/c1-4-20(26)25-12-11-15-5-8-18(13-16(15)14-25)24-21(27)22(2,3)28-19-9-6-17(23)7-10-19/h5-10,13H,4,11-12,14H2,1-3H3,(H,24,27)