3-[2-[(6-chloranyl-2-methyl-quinolin-4-yl)amino]ethyl-(4-methoxyphenyl)sulfonyl-amino]propanoic acid

Systemtic Name: 3-[2-[(6-chloranyl-2-methyl-quinolin-4-yl)amino]ethyl-(4-methoxyphenyl)sulfonyl-amino]propanoic acid Openeye Name: 3-[2-[(6-chloro-2-methyl-4-quinolyl)amino]ethyl-(4-methoxyphenyl)sulfonyl-amino]propanoic acid CAS Name: 3-[2-[(6-chloro-2-methyl-4-quinolinyl)amino]ethyl-(4-methoxyphenyl)sulfonylamino]propanoic acid IUPAC Name: 3-[2-[(6-chloro-2-methylquinolin-4-yl)amino]ethyl-(4-methoxyphenyl)sulfonylamino]propanoic acid Traditional Name: 3-[2-[(6-chloro-2-methyl-4-quinolyl)amino]ethyl-(4-methoxyphenyl)sulfonyl-amino]propionic acid Formula: C22H24ClN3O5S MolecularWeight: 477.96106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)Cl)C(=C1)NCCN(CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)Cl)C(=C1)NCCN(CCC(=O)O)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H24ClN3O5S/c1-15-13-21(19-14-16(23)3-8-20(19)25-15)24-10-12-26(11-9-22(27)28)32(29,30)18-6-4-17(31-2)5-7-18/h3-8,13-14H,9-12H2,1-2H3,(H,24,25)(H,27,28)