4-[3-[[1-(3-bromophenyl)sulfonylpiperidin-4-yl]methylamino]-2-oxidanyl-propoxy]phenol

Systemtic Name: 4-[3-[[1-(3-bromophenyl)sulfonylpiperidin-4-yl]methylamino]-2-oxidanyl-propoxy]phenol Openeye Name: 4-[3-[[1-(3-bromophenyl)sulfonyl-4-piperidyl]methylamino]-2-hydroxy-propoxy]phenol CAS Name: 4-[3-[[1-(3-bromophenyl)sulfonyl-4-piperidinyl]methylamino]-2-hydroxypropoxy]phenol IUPAC Name: 4-[3-[[1-(3-bromophenyl)sulfonylpiperidin-4-yl]methylamino]-2-hydroxypropoxy]phenol Traditional Name: 4-[3-[[1-(3-bromophenyl)sulfonyl-4-piperidyl]methylamino]-2-hydroxy-propoxy]phenol Formula: C21H27BrN2O5S MolecularWeight: 499.41848

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNCC(COC2=CC=C(C=C2)O)O)S(=O)(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1CN(CCC1CNCC(COC2=CC=C(C=C2)O)O)S(=O)(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H27BrN2O5S/c22-17-2-1-3-21(12-17)30(27,28)24-10-8-16(9-11-24)13-23-14-19(26)15-29-20-6-4-18(25)5-7-20/h1-7,12,16,19,23,25-26H,8-11,13-15H2