2-(4-chloranylphenoxy)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyrrolidin-1-ylcarbonyl-phenyl]ethanamide

Systemtic Name: 2-(4-chloranylphenoxy)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-pyrrolidin-1-ylcarbonyl-phenyl]ethanamide Openeye Name: 2-(4-chlorophenoxy)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]acetamide CAS Name: 2-(4-chlorophenoxy)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-[oxo(1-pyrrolidinyl)methyl]phenyl]acetamide IUPAC Name: 2-(4-chlorophenoxy)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]acetamide Traditional Name: 2-(4-chlorophenoxy)-N-[4-(3,4-dihydro-1H-isoquinolin-2-yl)-3-(pyrrolidine-1-carbonyl)phenyl]acetamide Formula: C28H28ClN3O3 MolecularWeight: 489.99322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)COC3=CC=C(C=C3)Cl)N4CCC5=CC=CC=C5C4

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(C=CC(=C2)NC(=O)COC3=CC=C(C=C3)Cl)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H28ClN3O3/c29-22-7-10-24(11-8-22)35-19-27(33)30-23-9-12-26(25(17-23)28(34)31-14-3-4-15-31)32-16-13-20-5-1-2-6-21(20)18-32/h1-2,5-12,17H,3-4,13-16,18-19H2,(H,30,33)