4-[2-[[3-[2-bromanyl-4-(2-methoxyethyl)phenoxy]-2-oxidanyl-propyl]amino]propyl]phenol

Systemtic Name: 4-[2-[[3-[2-bromanyl-4-(2-methoxyethyl)phenoxy]-2-oxidanyl-propyl]amino]propyl]phenol Openeye Name: 4-[2-[[3-[2-bromo-4-(2-methoxyethyl)phenoxy]-2-hydroxy-propyl]amino]propyl]phenol CAS Name: 4-[2-[[3-[2-bromo-4-(2-methoxyethyl)phenoxy]-2-hydroxypropyl]amino]propyl]phenol IUPAC Name: 4-[2-[[3-[2-bromo-4-(2-methoxyethyl)phenoxy]-2-hydroxypropyl]amino]propyl]phenol Traditional Name: 4-[2-[[3-[2-bromo-4-(2-methoxyethyl)phenoxy]-2-hydroxy-propyl]amino]propyl]phenol Formula: C21H28BrNO4 MolecularWeight: 438.35532

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=C(C=C1)O)NCC(COC2=C(C=C(C=C2)CCOC)Br)O

Isomeric SMILES

CC(CC1=CC=C(C=C1)O)NCC(COC2=C(C=C(C=C2)CCOC)Br)O

InChI

InChI=1S/C21H28BrNO4/c1-15(11-16-3-6-18(24)7-4-16)23-13-19(25)14-27-21-8-5-17(9-10-26-2)12-20(21)22/h3-8,12,15,19,23-25H,9-11,13-14H2,1-2H3