[4-[3-(dimethylamino)-6-dimethylazaniumylidene-xanthen-9-yl]phenyl]methyl-(4,5-dimethyl-3-oxidanylidene-hex-4-enyl)-dimethyl-azanium

Systemtic Name: [4-[3-(dimethylamino)-6-dimethylazaniumylidene-xanthen-9-yl]phenyl]methyl-(4,5-dimethyl-3-oxidanylidene-hex-4-enyl)-dimethyl-azanium Openeye Name: [4-[3-(dimethylamino)-6-dimethyliminio-xanthen-9-yl]phenyl]methyl-(4,5-dimethyl-3-oxo-hex-4-enyl)-dimethyl-ammonium CAS Name: [4-[3-(dimethylamino)-6-dimethyliminio-9-xanthenyl]phenyl]methyl-(4,5-dimethyl-3-oxohex-4-enyl)-dimethylammonium IUPAC Name: [4-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]phenyl]methyl-(4,5-dimethyl-3-oxohex-4-enyl)-dimethylazanium Traditional Name: [4-[3-(dimethylamino)-6-dimethyliminio-xanthen-9-yl]benzyl]-(3-keto-4,5-dimethyl-hex-4-enyl)-dimethyl-ammonium Formula: C34H43N3O2+2 MolecularWeight: 525.72412

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C)C(=O)CC[N+](C)(C)CC1=CC=C(C=C1)C2=C3C=CC(=[N+](C)C)C=C3OC4=C2C=CC(=C4)N(C)C)C

Isomeric SMILES

CC(=C(C)C(=O)CC[N+](C)(C)CC1=CC=C(C=C1)C2=C3C=CC(=[N+](C)C)C=C3OC4=C2C=CC(=C4)N(C)C)C

InChI

InChI=1S/C34H43N3O2/c1-23(2)24(3)31(38)18-19-37(8,9)22-25-10-12-26(13-11-25)34-29-16-14-27(35(4)5)20-32(29)39-33-21-28(36(6)7)15-17-30(33)34/h10-17,20-21H,18-19,22H2,1-9H3/q+2