ethyl 1-[2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-methyl-5-(2-methylpiperidin-1-yl)sulfonyl-phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[2-methyl-5-[(2-methyl-1-piperidyl)sulfonyl]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[2-methyl-5-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-methyl-5-(2-methylpiperidin-1-yl)sulfonylbenzoyl]piperidine-4-carboxylate Traditional Name: 1-[2-methyl-5-(2-methylpiperidino)sulfonyl-benzoyl]isonipecotic acid ethyl ester Formula: C22H32N2O5S MolecularWeight: 436.56488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3C)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCC3C)C

InChI

InChI=1S/C22H32N2O5S/c1-4-29-22(26)18-10-13-23(14-11-18)21(25)20-15-19(9-8-16(20)2)30(27,28)24-12-6-5-7-17(24)3/h8-9,15,17-18H,4-7,10-14H2,1-3H3