methyl (2R)-4-[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[(E)-3-(2-ethylbenzofuran-3-yl)prop-2-enoyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[(E)-3-(2-ethyl-3-benzofuranyl)-1-oxoprop-2-enyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[(E)-3-(2-ethyl-1-benzofuran-3-yl)prop-2-enoyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[(E)-3-(2-ethylbenzofuran-3-yl)acryloyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=CC=CC=C2O1)C=CC(=O)N3CCSC(C3)C(=O)OC

Isomeric SMILES

CCC1=C(C2=CC=CC=C2O1)/C=C/C(=O)N3CCS[C@H](C3)C(=O)OC

InChI

InChI=1S/C19H21NO4S/c1-3-15-14(13-6-4-5-7-16(13)24-15)8-9-18(21)20-10-11-25-17(12-20)19(22)23-2/h4-9,17H,3,10-12H2,1-2H3/b9-8+/t17-/m1/s1