9-(diethylamino)-5-(3-oxidanylidenebutylazaniumylidene)benzo[a]phenoxazine-3-sulfonate

Systemtic Name: 9-(diethylamino)-5-(3-oxidanylidenebutylazaniumylidene)benzo[a]phenoxazine-3-sulfonate Openeye Name: 9-(diethylamino)-5-(3-oxobutyliminio)benzo[a]phenoxazine-3-sulfonate CAS Name: 9-(diethylamino)-5-(3-oxobutyliminio)-3-benzo[a]phenoxazinesulfonate IUPAC Name: 9-(diethylamino)-5-(3-oxobutylazaniumylidene)benzo[a]phenoxazine-3-sulfonate Traditional Name: 9-(diethylamino)-5-(3-ketobutyliminio)benzo[a]phenoxazine-3-sulfonate Formula: C24H25N3O5S MolecularWeight: 467.5374

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)N=C3C4=C(C=C(C=C4)S(=O)(=O)[O-])C(=[NH+]CCC(=O)C)C=C3O2

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)N=C3C4=C(C=C(C=C4)S(=O)(=O)[O-])C(=[NH+]CCC(=O)C)C=C3O2

InChI

InChI=1S/C24H25N3O5S/c1-4-27(5-2)16-6-9-20-22(12-16)32-23-14-21(25-11-10-15(3)28)19-13-17(33(29,30)31)7-8-18(19)24(23)26-20/h6-9,12-14H,4-5,10-11H2,1-3H3,(H,29,30,31)