1-[[1-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperidin-4-yl]methylamino]-3-(4-phenylmethoxyphenoxy)propan-2-ol

Systemtic Name: 1-[[1-(4-bromanyl-2-ethyl-phenyl)sulfonylpiperidin-4-yl]methylamino]-3-(4-phenylmethoxyphenoxy)propan-2-ol Openeye Name: 1-(4-benzyloxyphenoxy)-3-[[1-(4-bromo-2-ethyl-phenyl)sulfonyl-4-piperidyl]methylamino]propan-2-ol CAS Name: 1-[[1-(4-bromo-2-ethylphenyl)sulfonyl-4-piperidinyl]methylamino]-3-(4-phenylmethoxyphenoxy)-2-propanol IUPAC Name: 1-[[1-(4-bromo-2-ethylphenyl)sulfonylpiperidin-4-yl]methylamino]-3-(4-phenylmethoxyphenoxy)propan-2-ol Traditional Name: 1-(4-benzoxyphenoxy)-3-[[1-(4-bromo-2-ethyl-phenyl)sulfonyl-4-piperidyl]methylamino]propan-2-ol Formula: C30H37BrN2O5S MolecularWeight: 617.59418

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCC(CC2)CNCC(COC3=CC=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)S(=O)(=O)N2CCC(CC2)CNCC(COC3=CC=C(C=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C30H37BrN2O5S/c1-2-25-18-26(31)8-13-30(25)39(35,36)33-16-14-23(15-17-33)19-32-20-27(34)22-38-29-11-9-28(10-12-29)37-21-24-6-4-3-5-7-24/h3-13,18,23,27,32,34H,2,14-17,19-22H2,1H3