ethyl 4-[2-(4-piperidin-1-ylsulfonylphenyl)ethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-(4-piperidin-1-ylsulfonylphenyl)ethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[4-(1-piperidylsulfonyl)phenyl]acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[1-oxo-2-[4-(1-piperidinylsulfonyl)phenyl]ethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(4-piperidin-1-ylsulfonylphenyl)acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(4-piperidinosulfonylphenyl)acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C21H31N3O5S MolecularWeight: 437.55294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H31N3O5S/c1-2-29-21(26)23-14-10-18(11-15-23)22-20(25)16-17-6-8-19(9-7-17)30(27,28)24-12-4-3-5-13-24/h6-9,18H,2-5,10-16H2,1H3,(H,22,25)