ethyl 4-(4-methoxy-3-piperidin-1-ylcarbonyl-phenyl)sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-(4-methoxy-3-piperidin-1-ylcarbonyl-phenyl)sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[4-methoxy-3-(piperidine-1-carbonyl)phenyl]sulfonylpiperazine-1-carboxylate CAS Name: 4-[4-methoxy-3-[oxo(1-piperidinyl)methyl]phenyl]sulfonyl-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-methoxy-3-(piperidine-1-carbonyl)phenyl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[4-methoxy-3-(piperidine-1-carbonyl)phenyl]sulfonylpiperazine-1-carboxylic acid ethyl ester Formula: C20H29N3O6S MolecularWeight: 439.52576

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCC3

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCC3

InChI

InChI=1S/C20H29N3O6S/c1-3-29-20(25)22-11-13-23(14-12-22)30(26,27)16-7-8-18(28-2)17(15-16)19(24)21-9-5-4-6-10-21/h7-8,15H,3-6,9-14H2,1-2H3