2-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-prop-2-enyl-butanamide

Systemtic Name: 2-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-prop-2-enyl-butanamide Openeye Name: N-allyl-2-[[2-propanoyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butanamide CAS Name: 2-[[1-(4-methylphenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-prop-2-enylbutanamide IUPAC Name: 2-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxy]-N-prop-2-enylbutanamide Traditional Name: N-allyl-2-[[2-propionyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxy]butyramide Formula: C26H32N2O3 MolecularWeight: 420.54388

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC=C)OC1=CC2=C(CCN(C2C3=CC=C(C=C3)C)C(=O)CC)C=C1

Isomeric SMILES

CCC(C(=O)NCC=C)OC1=CC2=C(CCN(C2C3=CC=C(C=C3)C)C(=O)CC)C=C1

InChI

InChI=1S/C26H32N2O3/c1-5-15-27-26(30)23(6-2)31-21-13-12-19-14-16-28(24(29)7-3)25(22(19)17-21)20-10-8-18(4)9-11-20/h5,8-13,17,23,25H,1,6-7,14-16H2,2-4H3,(H,27,30)