methyl 2-[2-(3-oxidanylnaphthalen-2-yl)carbonyloxyethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(3-oxidanylnaphthalen-2-yl)carbonyloxyethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[[2-(3-hydroxynaphthalene-2-carbonyl)oxyacetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-[(3-hydroxy-2-naphthalenyl)-oxomethoxy]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(3-hydroxynaphthalene-2-carbonyl)oxyacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-(3-hydroxy-2-naphthoyl)oxyacetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C23H21NO6S MolecularWeight: 439.48094

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC(=O)C3=CC4=CC=CC=C4C=C3O

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC(=O)C3=CC4=CC=CC=C4C=C3O

InChI

InChI=1S/C23H21NO6S/c1-29-23(28)20-15-8-4-5-9-18(15)31-21(20)24-19(26)12-30-22(27)16-10-13-6-2-3-7-14(13)11-17(16)25/h2-3,6-7,10-11,25H,4-5,8-9,12H2,1H3,(H,24,26)