3-(dimethylamino)propyl 3,5-ditert-butylbenzoate hydrochloride

Systemtic Name: 3-(dimethylamino)propyl 3,5-ditert-butylbenzoate hydrochloride Openeye Name: 3-(dimethylamino)propyl 3,5-ditert-butylbenzoate hydrochloride CAS Name: 3,5-ditert-butylbenzoic acid 3-(dimethylamino)propyl ester hydrochloride IUPAC Name: 3-(dimethylamino)propyl 3,5-ditert-butylbenzoate hydrochloride Traditional Name: 3,5-ditert-butylbenzoic acid 3-(dimethylamino)propyl ester hydrochloride Formula: C20H34ClNO2 MolecularWeight: 355.94246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C(=O)OCCCN(C)C)C(C)(C)C.Cl

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C(=O)OCCCN(C)C)C(C)(C)C.Cl

InChI

InChI=1S/C20H33NO2.ClH/c1-19(2,3)16-12-15(13-17(14-16)20(4,5)6)18(22)23-11-9-10-21(7)8;/h12-14H,9-11H2,1-8H3;1H