4-[(1R)-1-oxidanyl-2-[4-(4-phenylmethoxyphenyl)butylamino]ethyl]benzene-1,2-diol

Systemtic Name: 4-[(1R)-1-oxidanyl-2-[4-(4-phenylmethoxyphenyl)butylamino]ethyl]benzene-1,2-diol Openeye Name: 4-[(1R)-2-[4-(4-benzyloxyphenyl)butylamino]-1-hydroxy-ethyl]benzene-1,2-diol CAS Name: 4-[(1R)-1-hydroxy-2-[4-(4-phenylmethoxyphenyl)butylamino]ethyl]benzene-1,2-diol IUPAC Name: 4-[(1R)-1-hydroxy-2-[4-(4-phenylmethoxyphenyl)butylamino]ethyl]benzene-1,2-diol Traditional Name: 4-[(1R)-2-[4-(4-benzoxyphenyl)butylamino]-1-hydroxy-ethyl]pyrocatechol Formula: C25H29NO4 MolecularWeight: 407.50206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)CCCCNCC(C3=CC(=C(C=C3)O)O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)CCCCNC[C@@H](C3=CC(=C(C=C3)O)O)O

InChI

InChI=1S/C25H29NO4/c27-23-14-11-21(16-24(23)28)25(29)17-26-15-5-4-6-19-9-12-22(13-10-19)30-18-20-7-2-1-3-8-20/h1-3,7-14,16,25-29H,4-6,15,17-18H2/t25-/m0/s1