2-[[2-cyclopropylcarbonyl-1-(3-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-methylbutyl)propanamide

Systemtic Name: 2-[[2-cyclopropylcarbonyl-1-(3-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-methylbutyl)propanamide Openeye Name: 2-[[2-(cyclopropanecarbonyl)-1-(m-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-isopentyl-propanamide CAS Name: 2-[[2-[cyclopropyl(oxo)methyl]-1-(3-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-methylbutyl)propanamide IUPAC Name: 2-[[2-(cyclopropanecarbonyl)-1-(3-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-(3-methylbutyl)propanamide Traditional Name: 2-[[2-(cyclopropanecarbonyl)-1-(m-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-isoamyl-propionamide Formula: C28H36N2O3 MolecularWeight: 448.59704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2C3=C(CCN2C(=O)C4CC4)C=CC(=C3)OC(C)C(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2C3=C(CCN2C(=O)C4CC4)C=CC(=C3)OC(C)C(=O)NCCC(C)C

InChI

InChI=1S/C28H36N2O3/c1-18(2)12-14-29-27(31)20(4)33-24-11-10-21-13-15-30(28(32)22-8-9-22)26(25(21)17-24)23-7-5-6-19(3)16-23/h5-7,10-11,16-18,20,22,26H,8-9,12-15H2,1-4H3,(H,29,31)