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

Systemtic Name: methyl (2R)-4-[(E)-3-(4-methylphenyl)prop-2-enoyl]thiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-[(E)-3-(p-tolyl)prop-2-enoyl]thiomorpholine-2-carboxylate CAS Name: (2R)-4-[(E)-3-(4-methylphenyl)-1-oxoprop-2-enyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-[(E)-3-(4-methylphenyl)prop-2-enoyl]thiomorpholine-2-carboxylate Traditional Name: (2R)-4-[(E)-3-(p-tolyl)acryloyl]thiomorpholine-2-carboxylic acid methyl ester Formula: C16H19NO3S MolecularWeight: 305.39196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19NO3S/c1-12-3-5-13(6-4-12)7-8-15(18)17-9-10-21-14(11-17)16(19)20-2/h3-8,14H,9-11H2,1-2H3/b8-7+/t14-/m1/s1