Methylium, bis[4-(dimethylamino)phenyl][4-[benzyl[(4-sulfophenyl)methyl]amino]phenyl]-, inner salt

SpectraBase Compound ID	384WmyAyK4u
InChI	InChI=1S/C37H37N3O3S/c1-38(2)33-18-12-30(13-19-33)37(31-14-20-34(21-15-31)39(3)4)32-16-22-35(23-17-32)40(26-28-8-6-5-7-9-28)27-29-10-24-36(25-11-29)44(41,42)43/h5-25H,26-27H2,1-4H3
InChIKey	UEVJQKDTWHFAMG-UHFFFAOYSA-N Google Search
Mol Weight	603.8 g/mol
Molecular Formula	C37H37N3O3S
Exact Mass	603.255563 g/mol

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SpectraBase Spectrum ID	J0cBTMMs9ox
Name	Methylium, bis[4-(dimethylamino)phenyl][4-[benzyl[(4-sulfophenyl)methyl]amino]phenyl]-, inner salt
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	603.255563234 u
Formula	C37H37N3O3S
InChI	InChI=1S/C37H37N3O3S/c1-38(2)33-18-12-30(13-19-33)37(31-14-20-34(21-15-31)39(3)4)32-16-22-35(23-17-32)40(26-28-8-6-5-7-9-28)27-29-10-24-36(25-11-29)44(41,42)43/h5-25H,26-27H2,1-4H3
InChIKey	UEVJQKDTWHFAMG-UHFFFAOYSA-N
Molecular Weight	603.781 g/mol
SMILES	C1=C(C=CC(=C1)N(CC1=CC=CC=C1)CC1=CC=C(C=C1)S(=O)([O-])=O)C(=C1C=CC(C=C1)=[N+](C)C)C1=CC=C(C=C1)N(C)C