[9-(diethylamino)benzo[a]phenoxazin-5-ylidene]-diethyl-azanium ethanoate

Systemtic Name: [9-(diethylamino)benzo[a]phenoxazin-5-ylidene]-diethyl-azanium ethanoate Openeye Name: [9-(diethylamino)benzo[a]phenoxazin-5-ylidene]-diethyl-ammonium acetate CAS Name: [9-(diethylamino)-5-benzo[a]phenoxazinylidene]-diethylammonium acetate IUPAC Name: [9-(diethylamino)benzo[a]phenoxazin-5-ylidene]-diethylazanium acetate Traditional Name: [9-(diethylamino)benzo[a]phenoxazin-5-ylidene]-diethyl-ammonium acetate Formula: C26H31N3O3 MolecularWeight: 433.54264

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC2=C(C=C1)N=C3C4=CC=CC=C4C(=[N+](CC)CC)C=C3O2.CC(=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC2=C(C=C1)N=C3C4=CC=CC=C4C(=[N+](CC)CC)C=C3O2.CC(=O)[O-]

InChI

InChI=1S/C24H28N3O.C2H4O2/c1-5-26(6-2)17-13-14-20-22(15-17)28-23-16-21(27(7-3)8-4)18-11-9-10-12-19(18)24(23)25-20;1-2(3)4/h9-16H,5-8H2,1-4H3;1H3,(H,3,4)/q+1;/p-1