ethyl 3-[(1-quinolin-8-ylsulfonylpyrrolidin-2-yl)carbonylamino]benzoate

Systemtic Name: ethyl 3-[(1-quinolin-8-ylsulfonylpyrrolidin-2-yl)carbonylamino]benzoate Openeye Name: ethyl 3-[[1-(8-quinolylsulfonyl)pyrrolidine-2-carbonyl]amino]benzoate CAS Name: 3-[[oxo-[1-(8-quinolinylsulfonyl)-2-pyrrolidinyl]methyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(1-quinolin-8-ylsulfonylpyrrolidine-2-carbonyl)amino]benzoate Traditional Name: 3-[[1-(8-quinolylsulfonyl)prolyl]amino]benzoic acid ethyl ester Formula: C23H23N3O5S MolecularWeight: 453.51082

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C23H23N3O5S/c1-2-31-23(28)17-8-3-10-18(15-17)25-22(27)19-11-6-14-26(19)32(29,30)20-12-4-7-16-9-5-13-24-21(16)20/h3-5,7-10,12-13,15,19H,2,6,11,14H2,1H3,(H,25,27)