methyl 4-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-cyclopentyl-amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate

Systemtic Name: methyl 4-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-cyclopentyl-amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate Openeye Name: methyl 4-[2-[cyclopentyl-(1,1-dioxothiolan-3-yl)amino]-2-oxo-ethoxy]-3-methoxy-benzoate CAS Name: 4-[2-[cyclopentyl-(1,1-dioxo-3-thiolanyl)amino]-2-oxoethoxy]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[2-[cyclopentyl-(1,1-dioxothiolan-3-yl)amino]-2-oxoethoxy]-3-methoxybenzoate Traditional Name: 4-[2-[cyclopentyl-(1,1-diketothiolan-3-yl)amino]-2-keto-ethoxy]-3-methoxy-benzoic acid methyl ester Formula: C20H27NO7S MolecularWeight: 425.49588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)OC)OCC(=O)N(C2CCCC2)C3CCS(=O)(=O)C3

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)OC)OCC(=O)N(C2CCCC2)C3CCS(=O)(=O)C3

InChI

InChI=1S/C20H27NO7S/c1-26-18-11-14(20(23)27-2)7-8-17(18)28-12-19(22)21(15-5-3-4-6-15)16-9-10-29(24,25)13-16/h7-8,11,15-16H,3-6,9-10,12-13H2,1-2H3