5-[2-(4-chloranylphenoxy)ethanoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-yl-benzamide

Systemtic Name: 5-[2-(4-chloranylphenoxy)ethanoylamino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-yl-benzamide Openeye Name: 5-[[2-(4-chlorophenoxy)acetyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-benzamide CAS Name: 5-[[2-(4-chlorophenoxy)-1-oxoethyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-ylbenzamide IUPAC Name: 5-[[2-(4-chlorophenoxy)acetyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-propan-2-ylbenzamide Traditional Name: 5-[[2-(4-chlorophenoxy)acetyl]amino]-2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-isopropyl-benzamide Formula: C27H28ClN3O3 MolecularWeight: 477.98252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)COC2=CC=C(C=C2)Cl)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)NC(=O)C1=C(C=CC(=C1)NC(=O)COC2=CC=C(C=C2)Cl)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C27H28ClN3O3/c1-18(2)29-27(33)24-15-22(30-26(32)17-34-23-10-7-21(28)8-11-23)9-12-25(24)31-14-13-19-5-3-4-6-20(19)16-31/h3-12,15,18H,13-14,16-17H2,1-2H3,(H,29,33)(H,30,32)