ethyl 4-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-[(4-methyl-1-piperidyl)sulfonyl]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[4-[(4-methyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(4-methylpiperidin-1-yl)sulfonylbenzoyl]piperazine-1-carboxylate Traditional Name: 4-[4-(4-methylpiperidino)sulfonylbenzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCC(CC3)C

InChI

InChI=1S/C20H29N3O5S/c1-3-28-20(25)22-14-12-21(13-15-22)19(24)17-4-6-18(7-5-17)29(26,27)23-10-8-16(2)9-11-23/h4-7,16H,3,8-15H2,1-2H3