(4-dimethylaminophenyl)methyl-ethyl-[2-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: (4-dimethylaminophenyl)methyl-ethyl-[2-[[4-(4-ethylpiperazin-4-ium-1-yl)phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: (4-dimethylaminophenyl)methyl-ethyl-[2-[4-(4-ethylpiperazin-4-ium-1-yl)anilino]-2-oxo-ethyl]ammonium CAS Name: (4-dimethylaminophenyl)methyl-ethyl-[2-[4-(4-ethyl-1-piperazin-4-iumyl)anilino]-2-oxoethyl]ammonium IUPAC Name: (4-dimethylaminophenyl)methyl-ethyl-[2-[4-(4-ethylpiperazin-4-ium-1-yl)anilino]-2-oxoethyl]azanium Traditional Name: [4-(dimethylamino)benzyl]-ethyl-[2-[4-(4-ethylpiperazin-4-ium-1-yl)anilino]-2-keto-ethyl]ammonium Formula: C25H39N5O+2 MolecularWeight: 425.61006

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C[NH+](CC)CC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=C(C=C2)NC(=O)C[NH+](CC)CC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C25H37N5O/c1-5-28-15-17-30(18-16-28)24-13-9-22(10-14-24)26-25(31)20-29(6-2)19-21-7-11-23(12-8-21)27(3)4/h7-14H,5-6,15-20H2,1-4H3,(H,26,31)/p+2