(4-oxidanylidene-4-thiophen-2-yl-butyl) (E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoate

Systemtic Name: (4-oxidanylidene-4-thiophen-2-yl-butyl) (E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoate Openeye Name: [4-oxo-4-(2-thienyl)butyl] (E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-(4-hydroxy-3-methoxyphenyl)-2-propenoic acid (4-oxo-4-thiophen-2-ylbutyl) ester IUPAC Name: (4-oxo-4-thiophen-2-ylbutyl) (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-hydroxy-3-methoxy-phenyl)acrylic acid [4-keto-4-(2-thienyl)butyl] ester Formula: C18H18O5S MolecularWeight: 346.39752

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OCCCC(=O)C2=CC=CS2)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OCCCC(=O)C2=CC=CS2)O

InChI

InChI=1S/C18H18O5S/c1-22-16-12-13(6-8-14(16)19)7-9-18(21)23-10-2-4-15(20)17-5-3-11-24-17/h3,5-9,11-12,19H,2,4,10H2,1H3/b9-7+