(3-methylquinoxalin-2-yl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Openeye Name: (3-methylquinoxalin-2-yl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate CAS Name: 3-[(4-acetamidophenyl)sulfonylamino]propanoic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 3-[(4-acetamidophenyl)sulfonylamino]propanoate Traditional Name: 3-[(4-acetamidophenyl)sulfonylamino]propionic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C21H22N4O5S MolecularWeight: 442.48818

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)CCNS(=O)(=O)C3=CC=C(C=C3)NC(=O)C

InChI

InChI=1S/C21H22N4O5S/c1-14-20(25-19-6-4-3-5-18(19)23-14)13-30-21(27)11-12-22-31(28,29)17-9-7-16(8-10-17)24-15(2)26/h3-10,22H,11-13H2,1-2H3,(H,24,26)