ethyl 2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[2-(4-methyl-2-oxo-chromen-7-yl)oxypropanoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate CAS Name: 2-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]-4-(3-nitrophenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(4-methyl-2-oxochromen-7-yl)oxypropanoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylate Traditional Name: 2-[2-(2-keto-4-methyl-chromen-7-yl)oxypropanoylamino]-4-(3-nitrophenyl)thiophene-3-carboxylic acid ethyl ester Formula: C26H22N2O8S MolecularWeight: 522.52648

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C(C)OC3=CC4=C(C=C3)C(=CC(=O)O4)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C(C)OC3=CC4=C(C=C3)C(=CC(=O)O4)C

InChI

InChI=1S/C26H22N2O8S/c1-4-34-26(31)23-20(16-6-5-7-17(11-16)28(32)33)13-37-25(23)27-24(30)15(3)35-18-8-9-19-14(2)10-22(29)36-21(19)12-18/h5-13,15H,4H2,1-3H3,(H,27,30)