3-[[4-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]phenyl]-methyl-amino]benzenesulfonate

Systemtic Name: 3-[[4-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]phenyl]-methyl-amino]benzenesulfonate Openeye Name: 3-[4-[[4-(diethylamino)phenyl]-(4-diethyliminiocyclohexa-2,5-dien-1-ylidene)methyl]-N-methyl-anilino]benzenesulfonate CAS Name: 3-[4-[[4-(diethylamino)phenyl]-(4-diethyliminio-1-cyclohexa-2,5-dienylidene)methyl]-N-methylanilino]benzenesulfonate IUPAC Name: 3-[4-[[4-(diethylamino)phenyl]-(4-diethylazaniumylidenecyclohexa-2,5-dien-1-ylidene)methyl]-N-methylanilino]benzenesulfonate Traditional Name: 3-[4-[[4-(diethylamino)phenyl]-(4-diethyliminiocyclohexa-2,5-dien-1-ylidene)methyl]-N-methyl-anilino]besylate Formula: C34H39N3O3S MolecularWeight: 569.75676

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC=C(C=C3)N(C)C4=CC(=CC=C4)S(=O)(=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=C2C=CC(=[N+](CC)CC)C=C2)C3=CC=C(C=C3)N(C)C4=CC(=CC=C4)S(=O)(=O)[O-]

InChI

InChI=1S/C34H39N3O3S/c1-6-36(7-2)30-21-15-27(16-22-30)34(28-17-23-31(24-18-28)37(8-3)9-4)26-13-19-29(20-14-26)35(5)32-11-10-12-33(25-32)41(38,39)40/h10-25H,6-9H2,1-5H3