(3-methylquinoxalin-2-yl)methyl 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate Openeye Name: (3-methylquinoxalin-2-yl)methyl 1-(p-tolylsulfonyl)pyrrolidine-2-carboxylate CAS Name: 1-(4-methylphenyl)sulfonyl-2-pyrrolidinecarboxylic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 1-(4-methylphenyl)sulfonylpyrrolidine-2-carboxylate Traditional Name: 1-tosylpyrrolidine-2-carboxylic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OCC3=NC4=CC=CC=C4N=C3C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)OCC3=NC4=CC=CC=C4N=C3C

InChI

InChI=1S/C22H23N3O4S/c1-15-9-11-17(12-10-15)30(27,28)25-13-5-8-21(25)22(26)29-14-20-16(2)23-18-6-3-4-7-19(18)24-20/h3-4,6-7,9-12,21H,5,8,13-14H2,1-2H3