O1-ethyl O4-[[4-(4-oxidanylidene-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl] butanedioate

Systemtic Name: O1-ethyl O4-[[4-(4-oxidanylidene-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl] butanedioate Openeye Name: O1-ethyl O4-[[4-(4-oxo-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl] butanedioate CAS Name: butanedioic acid O1-ethyl ester O4-[[4-(4-oxo-8-phenyl-1-benzopyran-2-yl)-4-morpholin-4-iumyl]methyl] ester IUPAC Name: 1-O-ethyl 4-O-[[4-(4-oxo-8-phenylchromen-2-yl)morpholin-4-ium-4-yl]methyl] butanedioate Traditional Name: succinic acid O1-ethyl ester O4-[[4-(4-keto-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl] ester Formula: C26H28NO7+ MolecularWeight: 466.50302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)OC[N+]1(CCOCC1)C2=CC(=O)C3=C(O2)C(=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)CCC(=O)OC[N+]1(CCOCC1)C2=CC(=O)C3=C(O2)C(=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H28NO7/c1-2-32-24(29)11-12-25(30)33-18-27(13-15-31-16-14-27)23-17-22(28)21-10-6-9-20(26(21)34-23)19-7-4-3-5-8-19/h3-10,17H,2,11-16,18H2,1H3/q+1