[2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 2-ethylsulfinylbenzoate

Systemtic Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxidanylidene-ethyl] 2-ethylsulfinylbenzoate Openeye Name: [2-(chroman-4-ylamino)-2-oxo-ethyl] 2-ethylsulfinylbenzoate CAS Name: 2-ethylsulfinylbenzoic acid [2-(3,4-dihydro-2H-1-benzopyran-4-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dihydro-2H-chromen-4-ylamino)-2-oxoethyl] 2-ethylsulfinylbenzoate Traditional Name: 2-ethylsulfinylbenzoic acid [2-(chroman-4-ylamino)-2-keto-ethyl] ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)C1=CC=CC=C1C(=O)OCC(=O)NC2CCOC3=CC=CC=C23

Isomeric SMILES

CCS(=O)C1=CC=CC=C1C(=O)OCC(=O)NC2CCOC3=CC=CC=C23

InChI

InChI=1S/C20H21NO5S/c1-2-27(24)18-10-6-4-8-15(18)20(23)26-13-19(22)21-16-11-12-25-17-9-5-3-7-14(16)17/h3-10,16H,2,11-13H2,1H3,(H,21,22)