6-chloranyl-N-(5-ethylheptyl)-2-methoxy-acridin-9-amine dihydrochloride

Systemtic Name: 6-chloranyl-N-(5-ethylheptyl)-2-methoxy-acridin-9-amine dihydrochloride Openeye Name: 6-chloro-N-(5-ethylheptyl)-2-methoxy-acridin-9-amine dihydrochloride CAS Name: 6-chloro-N-(5-ethylheptyl)-2-methoxy-9-acridinamine dihydrochloride IUPAC Name: 6-chloro-N-(5-ethylheptyl)-2-methoxyacridin-9-amine dihydrochloride Traditional Name: (6-chloro-2-methoxy-acridin-9-yl)-(5-ethylheptyl)amine dihydrochloride Formula: C23H31Cl3N2O MolecularWeight: 457.86404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CCCCNC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC.Cl.Cl

Isomeric SMILES

CCC(CC)CCCCNC1=C2C=C(C=CC2=NC3=C1C=CC(=C3)Cl)OC.Cl.Cl

InChI

InChI=1S/C23H29ClN2O.2ClH/c1-4-16(5-2)8-6-7-13-25-23-19-11-9-17(24)14-22(19)26-21-12-10-18(27-3)15-20(21)23;;/h9-12,14-16H,4-8,13H2,1-3H3,(H,25,26);2*1H