ethyl 1-(2-methoxyethyl)-4-[4-[2-(3-phenylphenyl)ethoxy]phenyl]sulfonyl-piperidine-4-carboxylate

Systemtic Name: ethyl 1-(2-methoxyethyl)-4-[4-[2-(3-phenylphenyl)ethoxy]phenyl]sulfonyl-piperidine-4-carboxylate Openeye Name: ethyl 1-(2-methoxyethyl)-4-[4-[2-(3-phenylphenyl)ethoxy]phenyl]sulfonyl-piperidine-4-carboxylate CAS Name: 1-(2-methoxyethyl)-4-[4-[2-(3-phenylphenyl)ethoxy]phenyl]sulfonyl-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-methoxyethyl)-4-[4-[2-(3-phenylphenyl)ethoxy]phenyl]sulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-methoxyethyl)-4-[4-[2-(3-phenylphenyl)ethoxy]phenyl]sulfonyl-isonipecotic acid ethyl ester Formula: C31H37NO6S MolecularWeight: 551.69358

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)CCOC)S(=O)(=O)C2=CC=C(C=C2)OCCC3=CC=CC(=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)CCOC)S(=O)(=O)C2=CC=C(C=C2)OCCC3=CC=CC(=C3)C4=CC=CC=C4

InChI

InChI=1S/C31H37NO6S/c1-3-37-30(33)31(17-19-32(20-18-31)21-23-36-2)39(34,35)29-14-12-28(13-15-29)38-22-16-25-8-7-11-27(24-25)26-9-5-4-6-10-26/h4-15,24H,3,16-23H2,1-2H3