methyl 1,1-bis(oxidanylidene)-2-[(3-phenoxyphenyl)methyl]-1,2,5-thiadiazolidine-3-carboxylate

Systemtic Name: methyl 1,1-bis(oxidanylidene)-2-[(3-phenoxyphenyl)methyl]-1,2,5-thiadiazolidine-3-carboxylate Openeye Name: methyl 1,1-dioxo-2-[(3-phenoxyphenyl)methyl]-1,2,5-thiadiazolidine-3-carboxylate CAS Name: 1,1-dioxo-2-[(3-phenoxyphenyl)methyl]-1,2,5-thiadiazolidine-3-carboxylic acid methyl ester IUPAC Name: methyl 1,1-dioxo-2-[(3-phenoxyphenyl)methyl]-1,2,5-thiadiazolidine-3-carboxylate Traditional Name: 1,1-diketo-2-(3-phenoxybenzyl)-1,2,5-thiadiazolidine-3-carboxylic acid methyl ester Formula: C17H18N2O5S MolecularWeight: 362.40022

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CNS(=O)(=O)N1CC2=CC(=CC=C2)OC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CNS(=O)(=O)N1CC2=CC(=CC=C2)OC3=CC=CC=C3

InChI

InChI=1S/C17H18N2O5S/c1-23-17(20)16-11-18-25(21,22)19(16)12-13-6-5-9-15(10-13)24-14-7-3-2-4-8-14/h2-10,16,18H,11-12H2,1H3