1-azanyl-3-[1,5-bis(4-propan-2-ylphenyl)pentan-3-ylamino]propan-2-ol hydrate dihydrochloride

Systemtic Name: 1-azanyl-3-[1,5-bis(4-propan-2-ylphenyl)pentan-3-ylamino]propan-2-ol hydrate dihydrochloride Openeye Name: 1-amino-3-[[3-(4-isopropylphenyl)-1-[2-(4-isopropylphenyl)ethyl]propyl]amino]propan-2-ol hydrate dihydrochloride CAS Name: 1-amino-3-[1,5-bis(4-propan-2-ylphenyl)pentan-3-ylamino]-2-propanol hydrate dihydrochloride IUPAC Name: 1-amino-3-[1,5-bis(4-propan-2-ylphenyl)pentan-3-ylamino]propan-2-ol hydrate dihydrochloride Traditional Name: 1-amino-3-[[3-p-cumenyl-1-(2-p-cumenylethyl)propyl]amino]propan-2-ol hydrate dihydrochloride Formula: C26H44Cl2N2O2 MolecularWeight: 487.54576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CCC(CCC2=CC=C(C=C2)C(C)C)NCC(CN)O.O.Cl.Cl

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CCC(CCC2=CC=C(C=C2)C(C)C)NCC(CN)O.O.Cl.Cl

InChI

InChI=1S/C26H40N2O.2ClH.H2O/c1-19(2)23-11-5-21(6-12-23)9-15-25(28-18-26(29)17-27)16-10-22-7-13-24(14-8-22)20(3)4;;;/h5-8,11-14,19-20,25-26,28-29H,9-10,15-18,27H2,1-4H3;2*1H;1H2