ethyl 2-[2-(2-oxidanylidenechromen-7-yl)oxyethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-oxidanylidenechromen-7-yl)oxyethanoylamino]-5-propan-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 5-isopropyl-2-[[2-(2-oxochromen-7-yl)oxyacetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-[(2-oxo-1-benzopyran-7-yl)oxy]ethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-oxochromen-7-yl)oxyacetyl]amino]-5-propan-2-ylthiophene-3-carboxylate Traditional Name: 5-isopropyl-2-[[2-(2-ketochromen-7-yl)oxyacetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H21NO6S MolecularWeight: 415.45954

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)COC2=CC3=C(C=C2)C=CC(=O)O3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)COC2=CC3=C(C=C2)C=CC(=O)O3

InChI

InChI=1S/C21H21NO6S/c1-4-26-21(25)15-10-17(12(2)3)29-20(15)22-18(23)11-27-14-7-5-13-6-8-19(24)28-16(13)9-14/h5-10,12H,4,11H2,1-3H3,(H,22,23)