ethyl (5S)-5-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-phenylsulfanyl-cyclohex-3-ene-1-carboxylate

Systemtic Name: ethyl (5S)-5-[1,3-bis(oxidanylidene)isoindol-2-yl]-1-phenylsulfanyl-cyclohex-3-ene-1-carboxylate Openeye Name: ethyl (5S)-5-(1,3-dioxoisoindolin-2-yl)-1-phenylsulfanyl-cyclohex-3-ene-1-carboxylate CAS Name: (5S)-5-(1,3-dioxo-2-isoindolyl)-1-(phenylthio)-1-cyclohex-3-enecarboxylic acid ethyl ester IUPAC Name: ethyl (5S)-5-(1,3-dioxoisoindol-2-yl)-1-phenylsulfanylcyclohex-3-ene-1-carboxylate Traditional Name: (5S)-1-(phenylthio)-5-phthalimido-cyclohex-3-ene-1-carboxylic acid ethyl ester Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC=CC(C1)N2C(=O)C3=CC=CC=C3C2=O)SC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CC=C[C@H](C1)N2C(=O)C3=CC=CC=C3C2=O)SC4=CC=CC=C4

InChI

InChI=1S/C23H21NO4S/c1-2-28-22(27)23(29-17-10-4-3-5-11-17)14-8-9-16(15-23)24-20(25)18-12-6-7-13-19(18)21(24)26/h3-13,16H,2,14-15H2,1H3/t16-,23?/m1/s1