1-(dimethylamino)propan-2-yl 4-butoxybenzoate; hydron; chloride

Systemtic Name: 1-(dimethylamino)propan-2-yl 4-butoxybenzoate; hydron; chloride Openeye Name: [2-(dimethylamino)-1-methyl-ethyl] 4-butoxybenzoate; hydron; chloride CAS Name: 4-butoxybenzoic acid 1-(dimethylamino)propan-2-yl ester; hydron; chloride IUPAC Name: 1-(dimethylamino)propan-2-yl 4-butoxybenzoate; hydron; chloride Traditional Name: 4-butoxybenzoic acid [2-(dimethylamino)-1-methyl-ethyl] ester; hydron; chloride Formula: C16H26ClNO3 MolecularWeight: 315.83554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[H+].CCCCOC1=CC=C(C=C1)C(=O)OC(C)CN(C)C.[Cl-]

Isomeric SMILES

[H+].CCCCOC1=CC=C(C=C1)C(=O)OC(C)CN(C)C.[Cl-]

InChI

InChI=1S/C16H25NO3.ClH/c1-5-6-11-19-15-9-7-14(8-10-15)16(18)20-13(2)12-17(3)4;/h7-10,13H,5-6,11-12H2,1-4H3;1H