1-[1-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-2-piperazin-1-yl-ethyl]cyclohexan-1-ol

Systemtic Name: 1-[1-(3-bromanyl-5-methoxy-4-phenylmethoxy-phenyl)-2-piperazin-1-yl-ethyl]cyclohexan-1-ol Openeye Name: 1-[1-(4-benzyloxy-3-bromo-5-methoxy-phenyl)-2-piperazin-1-yl-ethyl]cyclohexanol CAS Name: 1-[1-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-2-(1-piperazinyl)ethyl]-1-cyclohexanol IUPAC Name: 1-[1-(3-bromo-5-methoxy-4-phenylmethoxyphenyl)-2-piperazin-1-ylethyl]cyclohexan-1-ol Traditional Name: 1-[1-(4-benzoxy-3-bromo-5-methoxy-phenyl)-2-piperazino-ethyl]cyclohexanol Formula: C26H35BrN2O3 MolecularWeight: 503.4717

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(CN2CCNCC2)C3(CCCCC3)O)Br)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C(=CC(=C1)C(CN2CCNCC2)C3(CCCCC3)O)Br)OCC4=CC=CC=C4

InChI

InChI=1S/C26H35BrN2O3/c1-31-24-17-21(16-23(27)25(24)32-19-20-8-4-2-5-9-20)22(18-29-14-12-28-13-15-29)26(30)10-6-3-7-11-26/h2,4-5,8-9,16-17,22,28,30H,3,6-7,10-15,18-19H2,1H3