ethyl 1-[2-(4-methoxyphenyl)ethyl]-4-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-(4-methoxyphenyl)ethyl]-4-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxylate Openeye Name: ethyl 1-[2-(4-methoxyphenyl)ethyl]-4-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxylate CAS Name: 1-[2-(4-methoxyphenyl)ethyl]-4-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(4-methoxyphenyl)ethyl]-4-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-[2-(4-methoxyphenyl)ethyl]-4-(4-methoxyphenyl)sulfonyl-isonipecotic acid ethyl ester Formula: C24H31NO6S MolecularWeight: 461.57104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CCC2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CCC2=CC=C(C=C2)OC)S(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C24H31NO6S/c1-4-31-23(26)24(32(27,28)22-11-9-21(30-3)10-12-22)14-17-25(18-15-24)16-13-19-5-7-20(29-2)8-6-19/h5-12H,4,13-18H2,1-3H3