5,5-dimethyl-4-(4-methylthiophen-2-yl)-3-(phenylmethyl)furan-2-one

Systemtic Name: 5,5-dimethyl-4-(4-methylthiophen-2-yl)-3-(phenylmethyl)furan-2-one Openeye Name: 3-benzyl-5,5-dimethyl-4-(4-methyl-2-thienyl)furan-2-one CAS Name: 5,5-dimethyl-4-(4-methyl-2-thiophenyl)-3-(phenylmethyl)-2-furanone IUPAC Name: 3-benzyl-5,5-dimethyl-4-(4-methylthiophen-2-yl)furan-2-one Traditional Name: 3-benzyl-5,5-dimethyl-4-(4-methyl-2-thienyl)furan-2-one Formula: C18H18O2S MolecularWeight: 298.39932

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C2=C(C(=O)OC2(C)C)CC3=CC=CC=C3

Isomeric SMILES

CC1=CSC(=C1)C2=C(C(=O)OC2(C)C)CC3=CC=CC=C3

InChI

InChI=1S/C18H18O2S/c1-12-9-15(21-11-12)16-14(17(19)20-18(16,2)3)10-13-7-5-4-6-8-13/h4-9,11H,10H2,1-3H3