5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-piperidin-4-ol; 4-nitrobenzoic acid; dihydrochloride

Systemtic Name: 5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-piperidin-4-ol; 4-nitrobenzoic acid; dihydrochloride Openeye Name: 5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-piperidin-4-ol; 4-nitrobenzoic acid; dihydrochloride CAS Name: 5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-4-piperidinol; 4-nitrobenzoic acid; dihydrochloride IUPAC Name: 5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenylpiperidin-4-ol; 4-nitrobenzoic acid; dihydrochloride Traditional Name: 5-(diethylaminomethyl)-1,2,5-trimethyl-4-phenyl-piperidin-4-ol; 4-nitrobenzoic acid; dihydrochloride Formula: C26H39Cl2N3O5 MolecularWeight: 544.51096

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)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

CCN(CC)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/C19H32N2O.C7H5NO4.2ClH/c1-6-21(7-2)15-18(4)14-20(5)16(3)13-19(18,22)17-11-9-8-10-12-17;9-7(10)5-1-3-6(4-2-5)8(11)12;;/h8-12,16,22H,6-7,13-15H2,1-5H3;1-4H,(H,9,10);2*1H