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

Systemtic Name: 5-(2-dimethylaminoethylamino)-2,2-dimethyl-pyrano[3,2-b]xanthen-6-one hydrochloride Openeye Name: 5-(2-dimethylaminoethylamino)-2,2-dimethyl-pyrano[3,2-b]xanthen-6-one hydrochloride CAS Name: 5-(2-dimethylaminoethylamino)-2,2-dimethyl-6-pyrano[3,2-b]xanthenone hydrochloride IUPAC Name: 5-(2-dimethylaminoethylamino)-2,2-dimethylpyrano[3,2-b]xanthen-6-one hydrochloride Traditional Name: 5-(2-dimethylaminoethylamino)-2,2-dimethyl-pyrano[3,2-b]xanthen-6-one hydrochloride Formula: C22H25ClN2O3 MolecularWeight: 400.8985

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=C(O1)C=C3C(=C2NCCN(C)C)C(=O)C4=CC=CC=C4O3)C.Cl

Isomeric SMILES

CC1(C=CC2=C(O1)C=C3C(=C2NCCN(C)C)C(=O)C4=CC=CC=C4O3)C.Cl

InChI

InChI=1S/C22H24N2O3.ClH/c1-22(2)10-9-14-17(27-22)13-18-19(20(14)23-11-12-24(3)4)21(25)15-7-5-6-8-16(15)26-18;/h5-10,13,23H,11-12H2,1-4H3;1H