3,6-bis(2-dimethylaminoethyloxy)xanthen-9-one dihydrochloride

Systemtic Name: 3,6-bis(2-dimethylaminoethyloxy)xanthen-9-one dihydrochloride Openeye Name: 3,6-bis(2-dimethylaminoethyloxy)xanthen-9-one dihydrochloride CAS Name: 3,6-bis(2-dimethylaminoethyloxy)-9-xanthenone dihydrochloride IUPAC Name: 3,6-bis(2-dimethylaminoethyloxy)xanthen-9-one dihydrochloride Traditional Name: 3,6-bis(2-dimethylaminoethyloxy)xanthone dihydrochloride Formula: C21H28Cl2N2O4 MolecularWeight: 443.36402

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=CC2=C(C=C1)C(=O)C3=C(O2)C=C(C=C3)OCCN(C)C.Cl.Cl

Isomeric SMILES

CN(C)CCOC1=CC2=C(C=C1)C(=O)C3=C(O2)C=C(C=C3)OCCN(C)C.Cl.Cl

InChI

InChI=1S/C21H26N2O4.2ClH/c1-22(2)9-11-25-15-5-7-17-19(13-15)27-20-14-16(26-12-10-23(3)4)6-8-18(20)21(17)24;;/h5-8,13-14H,9-12H2,1-4H3;2*1H