(3R)-2-[2-(3,5-dimethylphenoxy)ethanoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide

Systemtic Name: (3R)-2-[2-(3,5-dimethylphenoxy)ethanoyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Openeye Name: (3R)-2-[2-(3,5-dimethylphenoxy)acetyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide CAS Name: (3R)-2-[2-(3,5-dimethylphenoxy)-1-oxoethyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide IUPAC Name: (3R)-2-[2-(3,5-dimethylphenoxy)acetyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Traditional Name: (3R)-2-[2-(3,5-dimethylphenoxy)acetyl]-N-methyl-3,4-dihydro-1H-isoquinoline-3-carboxamide Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC(=O)N2CC3=CC=CC=C3CC2C(=O)NC)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC(=O)N2CC3=CC=CC=C3C[C@@H]2C(=O)NC)C

InChI

InChI=1S/C21H24N2O3/c1-14-8-15(2)10-18(9-14)26-13-20(24)23-12-17-7-5-4-6-16(17)11-19(23)21(25)22-3/h4-10,19H,11-13H2,1-3H3,(H,22,25)/t19-/m1/s1