3-[(6-chloranyl-2-methoxy-acridin-10-ium-9-yl)amino]propyl-(2-chloroethyl)-ethyl-azanium

Systemtic Name: 3-[(6-chloranyl-2-methoxy-acridin-10-ium-9-yl)amino]propyl-(2-chloroethyl)-ethyl-azanium Openeye Name: 2-chloroethyl-[3-[(6-chloro-2-methoxy-acridin-10-ium-9-yl)amino]propyl]-ethyl-ammonium CAS Name: 2-chloroethyl-[3-[(6-chloro-2-methoxy-9-acridin-10-iumyl)amino]propyl]-ethylammonium IUPAC Name: 2-chloroethyl-[3-[(6-chloro-2-methoxyacridin-10-ium-9-yl)amino]propyl]-ethylazanium Traditional Name: 2-chloroethyl-[3-[(6-chloro-2-methoxy-acridin-10-ium-9-yl)amino]propyl]-ethyl-ammonium Formula: C21H27Cl2N3O+2 MolecularWeight: 408.36458

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CCCNC1=C2C=C(C=CC2=[NH+]C3=C1C=CC(=C3)Cl)OC)CCCl

Isomeric SMILES

CC[NH+](CCCNC1=C2C=C(C=CC2=[NH+]C3=C1C=CC(=C3)Cl)OC)CCCl

InChI

InChI=1S/C21H25Cl2N3O/c1-3-26(12-9-22)11-4-10-24-21-17-7-5-15(23)13-20(17)25-19-8-6-16(27-2)14-18(19)21/h5-8,13-14H,3-4,9-12H2,1-2H3,(H,24,25)/p+2