(2-chloranyl-7-methyl-quinolin-3-yl)methyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate

Systemtic Name: (2-chloranyl-7-methyl-quinolin-3-yl)methyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate Openeye Name: (2-chloro-7-methyl-3-quinolyl)methyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate CAS Name: 3-[(4-ethoxyphenyl)sulfonylamino]propanoic acid (2-chloro-7-methyl-3-quinolinyl)methyl ester IUPAC Name: (2-chloro-7-methylquinolin-3-yl)methyl 3-[(4-ethoxyphenyl)sulfonylamino]propanoate Traditional Name: 3-(p-phenetylsulfonylamino)propionic acid (2-chloro-7-methyl-3-quinolyl)methyl ester Formula: C22H23ClN2O5S MolecularWeight: 462.94642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=C(N=C3C=C(C=CC3=C2)C)Cl

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=C(N=C3C=C(C=CC3=C2)C)Cl

InChI

InChI=1S/C22H23ClN2O5S/c1-3-29-18-6-8-19(9-7-18)31(27,28)24-11-10-21(26)30-14-17-13-16-5-4-15(2)12-20(16)25-22(17)23/h4-9,12-13,24H,3,10-11,14H2,1-2H3