methyl 1-[3-methyl-4-[(4-methylphenyl)sulfonylamino]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-[3-methyl-4-[(4-methylphenyl)sulfonylamino]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-[3-methyl-4-(p-tolylsulfonylamino)benzoyl]piperidine-4-carboxylate CAS Name: 1-[[3-methyl-4-[(4-methylphenyl)sulfonylamino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[3-methyl-4-[(4-methylphenyl)sulfonylamino]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[3-methyl-4-(tosylamino)benzoyl]isonipecotic acid methyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C(=O)N3CCC(CC3)C(=O)OC)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=C(C=C(C=C2)C(=O)N3CCC(CC3)C(=O)OC)C

InChI

InChI=1S/C22H26N2O5S/c1-15-4-7-19(8-5-15)30(27,28)23-20-9-6-18(14-16(20)2)21(25)24-12-10-17(11-13-24)22(26)29-3/h4-9,14,17,23H,10-13H2,1-3H3