ethyl 4-methyl-2-[3-(thiophen-3-ylcarbonylamino)propanoyloxymethyl]quinoline-3-carboxylate

Systemtic Name: ethyl 4-methyl-2-[3-(thiophen-3-ylcarbonylamino)propanoyloxymethyl]quinoline-3-carboxylate Openeye Name: ethyl 4-methyl-2-[3-(thiophene-3-carbonylamino)propanoyloxymethyl]quinoline-3-carboxylate CAS Name: 4-methyl-2-[[1-oxo-3-[[oxo(3-thiophenyl)methyl]amino]propoxy]methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-2-[3-(thiophene-3-carbonylamino)propanoyloxymethyl]quinoline-3-carboxylate Traditional Name: 4-methyl-2-[3-(3-thenoylamino)propanoyloxymethyl]quinoline-3-carboxylic acid ethyl ester Formula: C22H22N2O5S MolecularWeight: 426.48548

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CCNC(=O)C3=CSC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CCNC(=O)C3=CSC=C3)C

InChI

InChI=1S/C22H22N2O5S/c1-3-28-22(27)20-14(2)16-6-4-5-7-17(16)24-18(20)12-29-19(25)8-10-23-21(26)15-9-11-30-13-15/h4-7,9,11,13H,3,8,10,12H2,1-2H3,(H,23,26)