(Z)-6-[4-[(4-ethoxycarbonylphenyl)-ethyl-carbamothioyl]oxy-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoate

Systemtic Name: (Z)-6-[4-[(4-ethoxycarbonylphenyl)-ethyl-carbamothioyl]oxy-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoate Openeye Name: (Z)-6-[4-[(4-ethoxycarbonylphenyl)-ethyl-carbamothioyl]oxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-hex-4-enoate CAS Name: (Z)-6-[4-[(4-ethoxycarbonyl-N-ethylanilino)-sulfanylidenemethoxy]-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-4-hexenoate IUPAC Name: (Z)-6-[4-[(4-ethoxycarbonylphenyl)-ethylcarbamothioyl]oxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl]-4-methylhex-4-enoate Traditional Name: (Z)-6-[4-[(4-carbethoxyphenyl)-ethyl-thiocarbamoyl]oxy-3-keto-6-methoxy-7-methyl-phthalan-5-yl]-4-methyl-hex-4-enoate Formula: C29H32NO8S- MolecularWeight: 554.63128

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)C(=O)OCC)C(=S)OC2=C(C(=C(C3=C2C(=O)OC3)C)OC)CC=C(C)CCC(=O)[O-]

Isomeric SMILES

CCN(C1=CC=C(C=C1)C(=O)OCC)C(=S)OC2=C(C(=C(C3=C2C(=O)OC3)C)OC)C/C=C(/C)\CCC(=O)[O-]

InChI

InChI=1S/C29H33NO8S/c1-6-30(20-12-10-19(11-13-20)27(33)36-7-2)29(39)38-26-21(14-8-17(3)9-15-23(31)32)25(35-5)18(4)22-16-37-28(34)24(22)26/h8,10-13H,6-7,9,14-16H2,1-5H3,(H,31,32)/p-1/b17-8-