(2-ethoxyphenyl)methyl 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate

Systemtic Name: (2-ethoxyphenyl)methyl 2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Openeye Name: (2-ethoxyphenyl)methyl 2-[2-(isopropylamino)-2-oxo-ethyl]sulfanylbenzoate CAS Name: 2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]benzoic acid (2-ethoxyphenyl)methyl ester IUPAC Name: (2-ethoxyphenyl)methyl 2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylbenzoate Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]thio]benzoic acid (2-ethoxybenzyl) ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1COC(=O)C2=CC=CC=C2SCC(=O)NC(C)C

Isomeric SMILES

CCOC1=CC=CC=C1COC(=O)C2=CC=CC=C2SCC(=O)NC(C)C

InChI

InChI=1S/C21H25NO4S/c1-4-25-18-11-7-5-9-16(18)13-26-21(24)17-10-6-8-12-19(17)27-14-20(23)22-15(2)3/h5-12,15H,4,13-14H2,1-3H3,(H,22,23)