2-[1-(4-methoxyphenyl)but-3-ynyl]-2-(2-methylprop-2-enyl)indene-1,3-dione

Systemtic Name: 2-[1-(4-methoxyphenyl)but-3-ynyl]-2-(2-methylprop-2-enyl)indene-1,3-dione Openeye Name: 2-[1-(4-methoxyphenyl)but-3-ynyl]-2-(2-methylallyl)indane-1,3-dione CAS Name: 2-[1-(4-methoxyphenyl)but-3-ynyl]-2-(2-methylprop-2-enyl)indene-1,3-dione IUPAC Name: 2-[1-(4-methoxyphenyl)but-3-ynyl]-2-(2-methylprop-2-enyl)indene-1,3-dione Traditional Name: 2-[1-(4-methoxyphenyl)but-3-ynyl]-2-(2-methylallyl)indane-1,3-quinone Formula: C24H22O3 MolecularWeight: 358.42968

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC1(C(=O)C2=CC=CC=C2C1=O)C(CC#C)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=C)CC1(C(=O)C2=CC=CC=C2C1=O)C(CC#C)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H22O3/c1-5-8-21(17-11-13-18(27-4)14-12-17)24(15-16(2)3)22(25)19-9-6-7-10-20(19)23(24)26/h1,6-7,9-14,21H,2,8,15H2,3-4H3