ethyl 2-[2-[3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl]oxyethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[3-(3-methylphenoxy)-4-oxidanylidene-chromen-7-yl]oxyethanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[2-[3-(3-methylphenoxy)-4-oxo-chromen-7-yl]oxyacetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[2-[[3-(3-methylphenoxy)-4-oxo-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[3-(3-methylphenoxy)-4-oxochromen-7-yl]oxyacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[2-[4-keto-3-(3-methylphenoxy)chromen-7-yl]oxyacetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C29H27NO7S MolecularWeight: 533.59218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC3=CC4=C(C=C3)C(=O)C(=CO4)OC5=CC=CC(=C5)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)COC3=CC4=C(C=C3)C(=O)C(=CO4)OC5=CC=CC(=C5)C

InChI

InChI=1S/C29H27NO7S/c1-3-34-29(33)26-21-9-4-5-10-24(21)38-28(26)30-25(31)16-35-18-11-12-20-22(14-18)36-15-23(27(20)32)37-19-8-6-7-17(2)13-19/h6-8,11-15H,3-5,9-10,16H2,1-2H3,(H,30,31)