7-(4-azanylbutoxy)-3,4,8-trimethyl-chromen-2-one hydrochloride

Systemtic Name: 7-(4-azanylbutoxy)-3,4,8-trimethyl-chromen-2-one hydrochloride Openeye Name: 7-(4-aminobutoxy)-3,4,8-trimethyl-chromen-2-one hydrochloride CAS Name: 7-(4-aminobutoxy)-3,4,8-trimethyl-1-benzopyran-2-one hydrochloride IUPAC Name: 7-(4-aminobutoxy)-3,4,8-trimethylchromen-2-one hydrochloride Traditional Name: 7-(4-aminobutoxy)-3,4,8-trimethyl-coumarin hydrochloride Formula: C16H22ClNO3 MolecularWeight: 311.80378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCCCCN)C.Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C=CC(=C2C)OCCCCN)C.Cl

InChI

InChI=1S/C16H21NO3.ClH/c1-10-11(2)16(18)20-15-12(3)14(7-6-13(10)15)19-9-5-4-8-17;/h6-7H,4-5,8-9,17H2,1-3H3;1H