3-butyl-4-(4-phenylmethoxyphenyl)-2-pyrrolidin-3-ylsulfonyl-phenol

Systemtic Name: 3-butyl-4-(4-phenylmethoxyphenyl)-2-pyrrolidin-3-ylsulfonyl-phenol Openeye Name: 4-(4-benzyloxyphenyl)-3-butyl-2-pyrrolidin-3-ylsulfonyl-phenol CAS Name: 3-butyl-4-(4-phenylmethoxyphenyl)-2-(3-pyrrolidinylsulfonyl)phenol IUPAC Name: 3-butyl-4-(4-phenylmethoxyphenyl)-2-pyrrolidin-3-ylsulfonylphenol Traditional Name: 4-(4-benzoxyphenyl)-3-butyl-2-pyrrolidin-3-ylsulfonyl-phenol Formula: C27H31NO4S MolecularWeight: 465.60434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=CC(=C1S(=O)(=O)C2CCNC2)O)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

CCCCC1=C(C=CC(=C1S(=O)(=O)C2CCNC2)O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H31NO4S/c1-2-3-9-25-24(14-15-26(29)27(25)33(30,31)23-16-17-28-18-23)21-10-12-22(13-11-21)32-19-20-7-5-4-6-8-20/h4-8,10-15,23,28-29H,2-3,9,16-19H2,1H3