[4-(4-ethylpiperazin-4-ium-1-yl)quinolin-1-ium-3-yl]-(4-methoxyphenyl)methanone

Systemtic Name: [4-(4-ethylpiperazin-4-ium-1-yl)quinolin-1-ium-3-yl]-(4-methoxyphenyl)methanone Openeye Name: [4-(4-ethylpiperazin-4-ium-1-yl)quinolin-1-ium-3-yl]-(4-methoxyphenyl)methanone CAS Name: [4-(4-ethyl-1-piperazin-4-iumyl)-3-quinolin-1-iumyl]-(4-methoxyphenyl)methanone IUPAC Name: [4-(4-ethylpiperazin-4-ium-1-yl)quinolin-1-ium-3-yl]-(4-methoxyphenyl)methanone Traditional Name: [4-(4-ethylpiperazin-4-ium-1-yl)quinolin-1-ium-3-yl]-(4-methoxyphenyl)methanone Formula: C23H27N3O2+2 MolecularWeight: 377.47938

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=[NH+]C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)OC

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=[NH+]C3=CC=CC=C32)C(=O)C4=CC=C(C=C4)OC

InChI

InChI=1S/C23H25N3O2/c1-3-25-12-14-26(15-13-25)22-19-6-4-5-7-21(19)24-16-20(22)23(27)17-8-10-18(28-2)11-9-17/h4-11,16H,3,12-15H2,1-2H3/p+2