3,3-dimethyl-2-[2-(4-methylphenyl)-1H-indol-3-yl]but-1-en-1-one

Systemtic Name: 3,3-dimethyl-2-[2-(4-methylphenyl)-1H-indol-3-yl]but-1-en-1-one Openeye Name: 3,3-dimethyl-2-[2-(p-tolyl)-1H-indol-3-yl]but-1-en-1-one CAS Name: 3,3-dimethyl-2-[2-(4-methylphenyl)-1H-indol-3-yl]-1-buten-1-one IUPAC Name: 3,3-dimethyl-2-[2-(4-methylphenyl)-1H-indol-3-yl]but-1-en-1-one Traditional Name: 3,3-dimethyl-2-[2-(p-tolyl)-1H-indol-3-yl]but-1-en-1-one Formula: C21H21NO MolecularWeight: 303.39754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C(=C=O)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C(=C=O)C(C)(C)C

InChI

InChI=1S/C21H21NO/c1-14-9-11-15(12-10-14)20-19(17(13-23)21(2,3)4)16-7-5-6-8-18(16)22-20/h5-12,22H,1-4H3