ethyl 2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethanoyloxymethyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: ethyl 2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethanoyloxymethyl]-4-methyl-quinoline-3-carboxylate Openeye Name: ethyl 2-[[2-[(3-chlorobenzothiophene-2-carbonyl)amino]acetyl]oxymethyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]-1-oxoethoxy]methyl]-4-methyl-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]acetyl]oxymethyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[2-[(3-chlorobenzothiophene-2-carbonyl)amino]acetyl]oxymethyl]-4-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C25H21ClN2O5S MolecularWeight: 496.96264

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CNC(=O)C3=C(C4=CC=CC=C4S3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2N=C1COC(=O)CNC(=O)C3=C(C4=CC=CC=C4S3)Cl)C

InChI

InChI=1S/C25H21ClN2O5S/c1-3-32-25(31)21-14(2)15-8-4-6-10-17(15)28-18(21)13-33-20(29)12-27-24(30)23-22(26)16-9-5-7-11-19(16)34-23/h4-11H,3,12-13H2,1-2H3,(H,27,30)