(Z)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-methylphenyl)but-2-en-1-one

Systemtic Name: (Z)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-methylphenyl)but-2-en-1-one Openeye Name: (Z)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(p-tolyl)but-2-en-1-one CAS Name: (Z)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-methylphenyl)-2-buten-1-one IUPAC Name: (Z)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(4-methylphenyl)but-2-en-1-one Traditional Name: (Z)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-1-(p-tolyl)but-2-en-1-one Formula: C20H21NO MolecularWeight: 291.38684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C=C(C)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C=C(/C)\N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C20H21NO/c1-15-7-9-18(10-8-15)20(22)13-16(2)21-12-11-17-5-3-4-6-19(17)14-21/h3-10,13H,11-12,14H2,1-2H3/b16-13-