1-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-3-hexadecoxy-propan-2-ol

Systemtic Name: 1-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-3-hexadecoxy-propan-2-ol Openeye Name: 1-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-3-hexadecoxy-propan-2-ol CAS Name: 1-[4-[(3,4-dichlorophenyl)methyl]-1-piperazinyl]-3-hexadecoxy-2-propanol IUPAC Name: 1-[4-[(3,4-dichlorophenyl)methyl]piperazin-1-yl]-3-hexadecoxypropan-2-ol Traditional Name: 1-cetyloxy-3-[4-(3,4-dichlorobenzyl)piperazino]propan-2-ol Formula: C30H52Cl2N2O2 MolecularWeight: 543.65208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOCC(CN1CCN(CC1)CC2=CC(=C(C=C2)Cl)Cl)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOCC(CN1CCN(CC1)CC2=CC(=C(C=C2)Cl)Cl)O

InChI

InChI=1S/C30H52Cl2N2O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-22-36-26-28(35)25-34-20-18-33(19-21-34)24-27-16-17-29(31)30(32)23-27/h16-17,23,28,35H,2-15,18-22,24-26H2,1H3