5-[(2-dimethylaminoethylamino)methyl]-2,2-dimethyl-pyrano[3,2-b]xanthen-6-one hydrochloride

Systemtic Name: 5-[(2-dimethylaminoethylamino)methyl]-2,2-dimethyl-pyrano[3,2-b]xanthen-6-one hydrochloride Openeye Name: 5-[(2-dimethylaminoethylamino)methyl]-2,2-dimethyl-pyrano[3,2-b]xanthen-6-one hydrochloride CAS Name: 5-[(2-dimethylaminoethylamino)methyl]-2,2-dimethyl-6-pyrano[3,2-b]xanthenone hydrochloride IUPAC Name: 5-[(2-dimethylaminoethylamino)methyl]-2,2-dimethylpyrano[3,2-b]xanthen-6-one hydrochloride Traditional Name: 5-[(2-dimethylaminoethylamino)methyl]-2,2-dimethyl-pyrano[3,2-b]xanthen-6-one hydrochloride Formula: C23H27ClN2O3 MolecularWeight: 414.92508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=C(O1)C=C3C(=C2CNCCN(C)C)C(=O)C4=CC=CC=C4O3)C.Cl

Isomeric SMILES

CC1(C=CC2=C(O1)C=C3C(=C2CNCCN(C)C)C(=O)C4=CC=CC=C4O3)C.Cl

InChI

InChI=1S/C23H26N2O3.ClH/c1-23(2)10-9-15-17(14-24-11-12-25(3)4)21-20(13-19(15)28-23)27-18-8-6-5-7-16(18)22(21)26;/h5-10,13,24H,11-12,14H2,1-4H3;1H