ethyl 2-methyl-4-[(3-morpholin-4-ium-4-ylpropylamino)methylidene]-5-oxidanylidene-benzo[g][1]benzofuran-3-carboxylate

Systemtic Name: ethyl 2-methyl-4-[(3-morpholin-4-ium-4-ylpropylamino)methylidene]-5-oxidanylidene-benzo[g][1]benzofuran-3-carboxylate Openeye Name: ethyl 2-methyl-4-[(3-morpholin-4-ium-4-ylpropylamino)methylene]-5-oxo-benzo[g]benzofuran-3-carboxylate CAS Name: 2-methyl-4-[[3-(4-morpholin-4-iumyl)propylamino]methylidene]-5-oxo-3-benzo[g]benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-[(3-morpholin-4-ium-4-ylpropylamino)methylidene]-5-oxobenzo[g][1]benzofuran-3-carboxylate Traditional Name: 5-keto-2-methyl-4-[(3-morpholin-4-ium-4-ylpropylamino)methylene]benzo[g]benzofuran-3-carboxylic acid ethyl ester Formula: C24H29N2O5+ MolecularWeight: 425.49746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC2=C1C(=CNCCC[NH+]3CCOCC3)C(=O)C4=CC=CC=C42)C

Isomeric SMILES

CCOC(=O)C1=C(OC2=C1C(=CNCCC[NH+]3CCOCC3)C(=O)C4=CC=CC=C42)C

InChI

InChI=1S/C24H28N2O5/c1-3-30-24(28)20-16(2)31-23-18-8-5-4-7-17(18)22(27)19(21(20)23)15-25-9-6-10-26-11-13-29-14-12-26/h4-5,7-8,15,25H,3,6,9-14H2,1-2H3/p+1