(4-oxidanylidene-4-thiophen-2-yl-butyl) 4-methyl-2-oxidanyl-benzoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) 4-methyl-2-oxidanyl-benzoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] 2-hydroxy-4-methyl-benzoate CAS Name: 2-hydroxy-4-methylbenzoic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) 2-hydroxy-4-methylbenzoate Traditional Name: 2-hydroxy-4-methyl-benzoic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C16H16O4S MolecularWeight: 304.36084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)OCCCC(=O)C2=CC=CS2)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)OCCCC(=O)C2=CC=CS2)O

InChI

InChI=1S/C16H16O4S/c1-11-6-7-12(14(18)10-11)16(19)20-8-2-4-13(17)15-5-3-9-21-15/h3,5-7,9-10,18H,2,4,8H2,1H3