imidazol-1-yl-[4-[6-[3-methyl-1-(triphenylmethyl)pyrazol-1-ium-1-yl]quinolin-4-yl]piperazin-1-yl]methanone

Systemtic Name: imidazol-1-yl-[4-[6-[3-methyl-1-(triphenylmethyl)pyrazol-1-ium-1-yl]quinolin-4-yl]piperazin-1-yl]methanone Openeye Name: imidazol-1-yl-[4-[6-(3-methyl-1-trityl-pyrazol-1-ium-1-yl)-4-quinolyl]piperazin-1-yl]methanone CAS Name: 1-imidazolyl-[4-[6-[3-methyl-1-(triphenylmethyl)-1-pyrazol-1-iumyl]-4-quinolinyl]-1-piperazinyl]methanone IUPAC Name: imidazol-1-yl-[4-[6-(3-methyl-1-tritylpyrazol-1-ium-1-yl)quinolin-4-yl]piperazin-1-yl]methanone Traditional Name: imidazol-1-yl-[4-[6-(3-methyl-1-trityl-pyrazol-1-ium-1-yl)-4-quinolyl]piperazino]methanone Formula: C40H36N7O+ MolecularWeight: 630.76014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=N[N+](C=C1)(C2=CC3=C(C=CN=C3C=C2)N4CCN(CC4)C(=O)N5C=CN=C5)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8

Isomeric SMILES

CC1=N[N+](C=C1)(C2=CC3=C(C=CN=C3C=C2)N4CCN(CC4)C(=O)N5C=CN=C5)C(C6=CC=CC=C6)(C7=CC=CC=C7)C8=CC=CC=C8

InChI

InChI=1S/C40H36N7O/c1-31-20-28-47(43-31,40(32-11-5-2-6-12-32,33-13-7-3-8-14-33)34-15-9-4-10-16-34)35-17-18-37-36(29-35)38(19-21-42-37)44-24-26-45(27-25-44)39(48)46-23-22-41-30-46/h2-23,28-30H,24-27H2,1H3/q+1