methyl (2R)-4-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[(E)-3-(3,4-dimethoxyphenyl)-1-oxoprop-2-enyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enoyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[(E)-3-(3,4-dimethoxyphenyl)acryloyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C17H21NO5S MolecularWeight: 351.41734

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CC(=O)N2CCSC(C2)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/C(=O)N2CCS[C@H](C2)C(=O)OC)OC

InChI

InChI=1S/C17H21NO5S/c1-21-13-6-4-12(10-14(13)22-2)5-7-16(19)18-8-9-24-15(11-18)17(20)23-3/h4-7,10,15H,8-9,11H2,1-3H3/b7-5+/t15-/m1/s1