(4-phenylmethoxyphenyl) 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzoate

Systemtic Name: (4-phenylmethoxyphenyl) 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonyl-benzoate Openeye Name: (4-benzyloxyphenyl) 4-methoxy-3-[(2-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 4-methoxy-3-[(2-methyl-1-piperidinyl)sulfonyl]benzoic acid (4-phenylmethoxyphenyl) ester IUPAC Name: (4-phenylmethoxyphenyl) 4-methoxy-3-(2-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 4-methoxy-3-(2-methylpiperidino)sulfonyl-benzoic acid (4-benzoxyphenyl) ester Formula: C27H29NO6S MolecularWeight: 495.58726

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)OCC4=CC=CC=C4)OC

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)OC3=CC=C(C=C3)OCC4=CC=CC=C4)OC

InChI

InChI=1S/C27H29NO6S/c1-20-8-6-7-17-28(20)35(30,31)26-18-22(11-16-25(26)32-2)27(29)34-24-14-12-23(13-15-24)33-19-21-9-4-3-5-10-21/h3-5,9-16,18,20H,6-8,17,19H2,1-2H3