[1-[[[1,3-bis(oxidanylidene)-2-phenyl-isoquinolin-4-ylidene]methylamino]methyl]cyclohexyl]-dimethyl-azanium

Systemtic Name: [1-[[[1,3-bis(oxidanylidene)-2-phenyl-isoquinolin-4-ylidene]methylamino]methyl]cyclohexyl]-dimethyl-azanium Openeye Name: [1-[[(1,3-dioxo-2-phenyl-4-isoquinolylidene)methylamino]methyl]cyclohexyl]-dimethyl-ammonium CAS Name: [1-[[(1,3-dioxo-2-phenyl-4-isoquinolinylidene)methylamino]methyl]cyclohexyl]-dimethylammonium IUPAC Name: [1-[[(1,3-dioxo-2-phenylisoquinolin-4-ylidene)methylamino]methyl]cyclohexyl]-dimethylazanium Traditional Name: [1-[[(1,3-diketo-2-phenyl-4-isoquinolylidene)methylamino]methyl]cyclohexyl]-dimethyl-ammonium Formula: C25H30N3O2+ MolecularWeight: 404.5246

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C1(CCCCC1)CNC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=C4

Isomeric SMILES

C[NH+](C)C1(CCCCC1)CNC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2/c1-27(2)25(15-9-4-10-16-25)18-26-17-22-20-13-7-8-14-21(20)23(29)28(24(22)30)19-11-5-3-6-12-19/h3,5-8,11-14,17,26H,4,9-10,15-16,18H2,1-2H3/p+1