4-[(2Z)-2-[(2E,4E)-3,5-dicyano-5-isocyano-4-pyridin-3-yl-penta-2,4-dienylidene]-4-phenyl-quinolin-1-yl]butyl-trimethyl-azanium

Systemtic Name: 4-[(2Z)-2-[(2E,4E)-3,5-dicyano-5-isocyano-4-pyridin-3-yl-penta-2,4-dienylidene]-4-phenyl-quinolin-1-yl]butyl-trimethyl-azanium Openeye Name: 4-[(2Z)-2-[(2E,4E)-3,5-dicyano-5-isocyano-4-(3-pyridyl)penta-2,4-dienylidene]-4-phenyl-1-quinolyl]butyl-trimethyl-ammonium CAS Name: 4-[(2Z)-2-[(2E,4E)-3,5-dicyano-5-isocyano-4-(3-pyridinyl)penta-2,4-dienylidene]-4-phenyl-1-quinolinyl]butyl-trimethylammonium IUPAC Name: 4-[(2Z)-2-[(2E,4E)-3,5-dicyano-5-isocyano-4-pyridin-3-ylpenta-2,4-dienylidene]-4-phenylquinolin-1-yl]butyl-trimethylazanium Traditional Name: 4-[(2Z)-2-[(2E,4E)-3,5-dicyano-5-isocyano-4-(3-pyridyl)penta-2,4-dienylidene]-4-phenyl-1-quinolyl]butyl-trimethyl-ammonium Formula: C35H33N6+ MolecularWeight: 537.67672

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CCCCN1C2=CC=CC=C2C(=CC1=CC=C(C#N)C(=C(C#N)[N+]#[C-])C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[N+](C)(C)CCCCN\1C2=CC=CC=C2C(=C/C1=C/C=C(/C#N)\C(=C(/C#N)\[N+]#[C-])\C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C35H33N6/c1-38-33(25-37)35(29-15-12-20-39-26-29)28(24-36)18-19-30-23-32(27-13-6-5-7-14-27)31-16-8-9-17-34(31)40(30)21-10-11-22-41(2,3)4/h5-9,12-20,23,26H,10-11,21-22H2,2-4H3/q+1/b28-18-,30-19-,35-33-