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4-[2-[7-[(2-oxidanyl-2-phenyl-ethyl)amino]heptyl]phenyl]butanoic acid
4-[2-[7-[(2-oxidanyl-2-phenyl-ethyl)amino]heptyl]phenyl]butanoic acid
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Descriptors Computed from Structure
Canonical SMILES:
C1=CC=C(C=C1)C(CNCCCCCCCC2=CC=CC=C2CCCC(=O)O)O
Isomeric SMILES
C1=CC=C(C=C1)C(CNCCCCCCCC2=CC=CC=C2CCCC(=O)O)O
InChI
InChI=1S/C25H35NO3/c27-24(23-15-6-4-7-16-23)20-26-19-10-3-1-2-5-12-21-13-8-9-14-22(21)17-11-18-25(28)29/h4,6-9,13-16,24,26-27H,1-3,5,10-12,17-20H2,(H,28,29)
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- trimethyl-(3-methylsulfonyl-4-oxidanyl-4-oxidanylidene-2-phenylmethoxy-butyl)azanium
