1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-6-methyl-3-phenyl-heptan-4-ol

Systemtic Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-6-methyl-3-phenyl-heptan-4-ol Openeye Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-6-methyl-3-phenyl-heptan-4-ol CAS Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)-1-piperazinyl]-6-methyl-3-phenyl-4-heptanol IUPAC Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazin-1-yl]-6-methyl-3-phenylheptan-4-ol Traditional Name: 1-[4-(2,3-dihydro-1,4-benzodioxin-5-yl)piperazino]-6-methyl-3-phenyl-heptan-4-ol Formula: C26H36N2O3 MolecularWeight: 424.57564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(CCN1CCN(CC1)C2=C3C(=CC=C2)OCCO3)C4=CC=CC=C4)O

Isomeric SMILES

CC(C)CC(C(CCN1CCN(CC1)C2=C3C(=CC=C2)OCCO3)C4=CC=CC=C4)O

InChI

InChI=1S/C26H36N2O3/c1-20(2)19-24(29)22(21-7-4-3-5-8-21)11-12-27-13-15-28(16-14-27)23-9-6-10-25-26(23)31-18-17-30-25/h3-10,20,22,24,29H,11-19H2,1-2H3