ethyl 2-[2-[(E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoyl]oxyethanoylamino]-4-ethanoyl-5-methyl-furan-3-carboxylate

Systemtic Name: ethyl 2-[2-[(E)-3-(3-chloranyl-1-benzothiophen-2-yl)prop-2-enoyl]oxyethanoylamino]-4-ethanoyl-5-methyl-furan-3-carboxylate Openeye Name: ethyl 4-acetyl-2-[[2-[(E)-3-(3-chlorobenzothiophen-2-yl)prop-2-enoyl]oxyacetyl]amino]-5-methyl-furan-3-carboxylate CAS Name: 4-acetyl-2-[[2-[(E)-3-(3-chloro-1-benzothiophen-2-yl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]-5-methyl-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyl-2-[[2-[(E)-3-(3-chloro-1-benzothiophen-2-yl)prop-2-enoyl]oxyacetyl]amino]-5-methylfuran-3-carboxylate Traditional Name: 4-acetyl-2-[[2-[(E)-3-(3-chlorobenzothiophen-2-yl)acryloyl]oxyacetyl]amino]-5-methyl-furan-3-carboxylic acid ethyl ester Formula: C23H20ClNO7S MolecularWeight: 489.9254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)COC(=O)C=CC2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)C)C)NC(=O)COC(=O)/C=C/C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C23H20ClNO7S/c1-4-30-23(29)20-19(12(2)26)13(3)32-22(20)25-17(27)11-31-18(28)10-9-16-21(24)14-7-5-6-8-15(14)33-16/h5-10H,4,11H2,1-3H3,(H,25,27)/b10-9+