2-(diethylamino)-1-phenyl-propan-1-ol; pentanoate; hydrochloride

Systemtic Name: 2-(diethylamino)-1-phenyl-propan-1-ol; pentanoate; hydrochloride Openeye Name: 2-(diethylamino)-1-phenyl-propan-1-ol; pentanoate; hydrochloride CAS Name: 2-(diethylamino)-1-phenyl-1-propanol; pentanoate; hydrochloride IUPAC Name: 2-(diethylamino)-1-phenylpropan-1-ol; pentanoate; hydrochloride Traditional Name: 2-(diethylamino)-1-phenyl-propan-1-ol; valerate; hydrochloride Formula: C18H31ClNO3- MolecularWeight: 344.89664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)[O-].CCN(CC)C(C)C(C1=CC=CC=C1)O.Cl

Isomeric SMILES

CCCCC(=O)[O-].CCN(CC)C(C)C(C1=CC=CC=C1)O.Cl

InChI

InChI=1S/C13H21NO.C5H10O2.ClH/c1-4-14(5-2)11(3)13(15)12-9-7-6-8-10-12;1-2-3-4-5(6)7;/h6-11,13,15H,4-5H2,1-3H3;2-4H2,1H3,(H,6,7);1H/p-1