4-[1-[4-(3-phenylmethoxyphenyl)butyl]pyrrolidin-3-yl]sulfonylphenol

Systemtic Name: 4-[1-[4-(3-phenylmethoxyphenyl)butyl]pyrrolidin-3-yl]sulfonylphenol Openeye Name: 4-[1-[4-(3-benzyloxyphenyl)butyl]pyrrolidin-3-yl]sulfonylphenol CAS Name: 4-[[1-[4-(3-phenylmethoxyphenyl)butyl]-3-pyrrolidinyl]sulfonyl]phenol IUPAC Name: 4-[1-[4-(3-phenylmethoxyphenyl)butyl]pyrrolidin-3-yl]sulfonylphenol Traditional Name: 4-[1-[4-(3-benzoxyphenyl)butyl]pyrrolidin-3-yl]sulfonylphenol Formula: C27H31NO4S MolecularWeight: 465.60434

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1S(=O)(=O)C2=CC=C(C=C2)O)CCCCC3=CC(=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1CN(CC1S(=O)(=O)C2=CC=C(C=C2)O)CCCCC3=CC(=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H31NO4S/c29-24-12-14-26(15-13-24)33(30,31)27-16-18-28(20-27)17-5-4-7-22-10-6-11-25(19-22)32-21-23-8-2-1-3-9-23/h1-3,6,8-15,19,27,29H,4-5,7,16-18,20-21H2