(3-methylquinoxalin-2-yl)methyl 4-methylsulfonylbenzoate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 4-methylsulfonylbenzoate Openeye Name: (3-methylquinoxalin-2-yl)methyl 4-methylsulfonylbenzoate CAS Name: 4-methylsulfonylbenzoic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 4-methylsulfonylbenzoate Traditional Name: 4-mesylbenzoic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C18H16N2O4S MolecularWeight: 356.39564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C18H16N2O4S/c1-12-17(20-16-6-4-3-5-15(16)19-12)11-24-18(21)13-7-9-14(10-8-13)25(2,22)23/h3-10H,11H2,1-2H3