[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-cyclohexyl-amino]-2-oxidanylidene-ethyl] 2-phenoxypropanoate

Systemtic Name: [2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-cyclohexyl-amino]-2-oxidanylidene-ethyl] 2-phenoxypropanoate Openeye Name: [2-[cyclohexyl-(1,1-dioxothiolan-3-yl)amino]-2-oxo-ethyl] 2-phenoxypropanoate CAS Name: 2-phenoxypropanoic acid [2-[cyclohexyl-(1,1-dioxo-3-thiolanyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclohexyl-(1,1-dioxothiolan-3-yl)amino]-2-oxoethyl] 2-phenoxypropanoate Traditional Name: 2-phenoxypropionic acid [2-[cyclohexyl-(1,1-diketothiolan-3-yl)amino]-2-keto-ethyl] ester Formula: C21H29NO6S MolecularWeight: 423.52306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCC(=O)N(C1CCCCC1)C2CCS(=O)(=O)C2)OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)OCC(=O)N(C1CCCCC1)C2CCS(=O)(=O)C2)OC3=CC=CC=C3

InChI

InChI=1S/C21H29NO6S/c1-16(28-19-10-6-3-7-11-19)21(24)27-14-20(23)22(17-8-4-2-5-9-17)18-12-13-29(25,26)15-18/h3,6-7,10-11,16-18H,2,4-5,8-9,12-15H2,1H3