[4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] (3R)-1-(3-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] (3R)-1-(3-ethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] (3R)-1-(3-ethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: (3R)-1-(3-ethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] ester IUPAC Name: [4-(1,3-dithiolan-2-yl)-2-methoxyphenyl] (3R)-1-(3-ethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: (3R)-1-(3-ethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [4-(1,3-dithiolan-2-yl)-2-methoxy-phenyl] ester Formula: C23H25NO4S2 MolecularWeight: 443.5789

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)N2CC(CC2=O)C(=O)OC3=C(C=C(C=C3)C4SCCS4)OC

Isomeric SMILES

CCC1=CC(=CC=C1)N2C[C@@H](CC2=O)C(=O)OC3=C(C=C(C=C3)C4SCCS4)OC

InChI

InChI=1S/C23H25NO4S2/c1-3-15-5-4-6-18(11-15)24-14-17(13-21(24)25)22(26)28-19-8-7-16(12-20(19)27-2)23-29-9-10-30-23/h4-8,11-12,17,23H,3,9-10,13-14H2,1-2H3/t17-/m1/s1