N-butyl-N-[3-[4-(phenylsulfonyl)phenoxy]propyl]butan-1-amine

Systemtic Name: N-butyl-N-[3-[4-(phenylsulfonyl)phenoxy]propyl]butan-1-amine Openeye Name: N-[3-[4-(benzenesulfonyl)phenoxy]propyl]-N-butyl-butan-1-amine CAS Name: N-[3-[4-(benzenesulfonyl)phenoxy]propyl]-N-butyl-1-butanamine IUPAC Name: N-[3-[4-(benzenesulfonyl)phenoxy]propyl]-N-butylbutan-1-amine Traditional Name: 3-(4-besylphenoxy)propyl-dibutyl-amine Formula: C23H33NO3S MolecularWeight: 403.57802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCOC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCN(CCCC)CCCOC1=CC=C(C=C1)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C23H33NO3S/c1-3-5-17-24(18-6-4-2)19-10-20-27-21-13-15-23(16-14-21)28(25,26)22-11-8-7-9-12-22/h7-9,11-16H,3-6,10,17-20H2,1-2H3