[4-[bis[4-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethyl-azanium

Systemtic Name: [4-[bis[4-(4-oxidanyl-4-oxidanylidene-butoxy)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethyl-azanium Openeye Name: [4-[bis[4-(4-hydroxy-4-oxo-butoxy)phenyl]methylene]cyclohexa-2,5-dien-1-ylidene]-dimethyl-ammonium CAS Name: [4-[bis[4-(4-hydroxy-4-oxobutoxy)phenyl]methylidene]-1-cyclohexa-2,5-dienylidene]-dimethylammonium IUPAC Name: [4-[bis[4-(4-hydroxy-4-oxobutoxy)phenyl]methylidene]cyclohexa-2,5-dien-1-ylidene]-dimethylazanium Traditional Name: [4-[bis[4-(4-hydroxy-4-keto-butoxy)phenyl]methylene]cyclohexa-2,5-dien-1-ylidene]-dimethyl-ammonium Formula: C29H32NO6+ MolecularWeight: 490.56748

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](=C1C=CC(=C(C2=CC=C(C=C2)OCCCC(=O)O)C3=CC=C(C=C3)OCCCC(=O)O)C=C1)C

Isomeric SMILES

C[N+](=C1C=CC(=C(C2=CC=C(C=C2)OCCCC(=O)O)C3=CC=C(C=C3)OCCCC(=O)O)C=C1)C

InChI

InChI=1S/C29H31NO6/c1-30(2)24-13-7-21(8-14-24)29(22-9-15-25(16-10-22)35-19-3-5-27(31)32)23-11-17-26(18-12-23)36-20-4-6-28(33)34/h7-18H,3-6,19-20H2,1-2H3,(H-,31,32,33,34)/p+1