(2-chloranylquinolin-3-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]ethanoate

Systemtic Name: (2-chloranylquinolin-3-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]ethanoate Openeye Name: (2-chloro-3-quinolyl)methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate CAS Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid (2-chloro-3-quinolinyl)methyl ester IUPAC Name: (2-chloroquinolin-3-yl)methyl 2-[(4-acetamidophenyl)sulfonylamino]acetate Traditional Name: 2-[(4-acetamidophenyl)sulfonylamino]acetic acid (2-chloro-3-quinolyl)methyl ester Formula: C20H18ClN3O5S MolecularWeight: 447.89202

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CC3=CC=CC=C3N=C2Cl

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CC3=CC=CC=C3N=C2Cl

InChI

InChI=1S/C20H18ClN3O5S/c1-13(25)23-16-6-8-17(9-7-16)30(27,28)22-11-19(26)29-12-15-10-14-4-2-3-5-18(14)24-20(15)21/h2-10,22H,11-12H2,1H3,(H,23,25)