methyl (2R)-4-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]thiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[(E)-3-(2-methoxy-5-methylphenyl)-1-oxoprop-2-enyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[(E)-3-(2-methoxy-5-methylphenyl)prop-2-enoyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[(E)-3-(2-methoxy-5-methyl-phenyl)acryloyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C17H21NO4S MolecularWeight: 335.41794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)C=CC(=O)N2CCSC(C2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OC)/C=C/C(=O)N2CCS[C@H](C2)C(=O)OC

InChI

InChI=1S/C17H21NO4S/c1-12-4-6-14(21-2)13(10-12)5-7-16(19)18-8-9-23-15(11-18)17(20)22-3/h4-7,10,15H,8-9,11H2,1-3H3/b7-5+/t15-/m1/s1