(3-methylquinoxalin-2-yl)methyl 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate Openeye Name: (3-methylquinoxalin-2-yl)methyl 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate CAS Name: 1-(4-chlorophenyl)sulfonyl-3-piperidinecarboxylic acid (3-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-2-yl)methyl 1-(4-chlorophenyl)sulfonylpiperidine-3-carboxylate Traditional Name: 1-(4-chlorophenyl)sulfonylnipecotic acid (3-methylquinoxalin-2-yl)methyl ester Formula: C22H22ClN3O4S MolecularWeight: 459.94578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)C3CCCN(C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H22ClN3O4S/c1-15-21(25-20-7-3-2-6-19(20)24-15)14-30-22(27)16-5-4-12-26(13-16)31(28,29)18-10-8-17(23)9-11-18/h2-3,6-11,16H,4-5,12-14H2,1H3