methyl (2R)-4-[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylthiomorpholine-2-carboxylate

Systemtic Name: methyl (2R)-4-[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylthiomorpholine-2-carboxylate Openeye Name: methyl (2R)-4-(2-allyl-1,3-dioxo-isoindoline-5-carbonyl)thiomorpholine-2-carboxylate CAS Name: (2R)-4-[(1,3-dioxo-2-prop-2-enyl-5-isoindolyl)-oxomethyl]-2-thiomorpholinecarboxylic acid methyl ester IUPAC Name: methyl (2R)-4-(1,3-dioxo-2-prop-2-enylisoindole-5-carbonyl)thiomorpholine-2-carboxylate Traditional Name: (2R)-4-(2-allyl-1,3-diketo-isoindoline-5-carbonyl)thiomorpholine-2-carboxylic acid methyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCS1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

Isomeric SMILES

COC(=O)[C@H]1CN(CCS1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

InChI

InChI=1S/C18H18N2O5S/c1-3-6-20-16(22)12-5-4-11(9-13(12)17(20)23)15(21)19-7-8-26-14(10-19)18(24)25-2/h3-5,9,14H,1,6-8,10H2,2H3/t14-/m1/s1