5-[(dibutylamino)methyl]-1,2,5-trimethyl-4-phenyl-piperidin-4-ol; 4-nitrobenzoic acid; dihydrochloride

Systemtic Name: 5-[(dibutylamino)methyl]-1,2,5-trimethyl-4-phenyl-piperidin-4-ol; 4-nitrobenzoic acid; dihydrochloride Openeye Name: 5-[(dibutylamino)methyl]-1,2,5-trimethyl-4-phenyl-piperidin-4-ol; 4-nitrobenzoic acid; dihydrochloride CAS Name: 5-[(dibutylamino)methyl]-1,2,5-trimethyl-4-phenyl-4-piperidinol; 4-nitrobenzoic acid; dihydrochloride IUPAC Name: 5-[(dibutylamino)methyl]-1,2,5-trimethyl-4-phenylpiperidin-4-ol; 4-nitrobenzoic acid; dihydrochloride Traditional Name: 5-[(dibutylamino)methyl]-1,2,5-trimethyl-4-phenyl-piperidin-4-ol; 4-nitrobenzoic acid; dihydrochloride Formula: C30H47Cl2N3O5 MolecularWeight: 600.61728

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CC1(CN(C(CC1(C2=CC=CC=C2)O)C)C)C.C1=CC(=CC=C1C(=O)O)[N+](=O)[O-].Cl.Cl

Isomeric SMILES

CCCCN(CCCC)CC1(CN(C(CC1(C2=CC=CC=C2)O)C)C)C.C1=CC(=CC=C1C(=O)O)[N+](=O)[O-].Cl.Cl

InChI

InChI=1S/C23H40N2O.C7H5NO4.2ClH/c1-6-8-15-25(16-9-7-2)19-22(4)18-24(5)20(3)17-23(22,26)21-13-11-10-12-14-21;9-7(10)5-1-3-6(4-2-5)8(11)12;;/h10-14,20,26H,6-9,15-19H2,1-5H3;1-4H,(H,9,10);2*1H