O1-(1,3-dioxolan-4-ylmethyl) O4-[[4-(4-oxidanylidene-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl] butanedioate

Systemtic Name: O1-(1,3-dioxolan-4-ylmethyl) O4-[[4-(4-oxidanylidene-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl] butanedioate Openeye Name: O1-(1,3-dioxolan-4-ylmethyl) O4-[[4-(4-oxo-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl] butanedioate CAS Name: butanedioic acid O1-(1,3-dioxolan-4-ylmethyl) ester O4-[[4-(4-oxo-8-phenyl-1-benzopyran-2-yl)-4-morpholin-4-iumyl]methyl] ester IUPAC Name: 1-O-(1,3-dioxolan-4-ylmethyl) 4-O-[[4-(4-oxo-8-phenylchromen-2-yl)morpholin-4-ium-4-yl]methyl] butanedioate Traditional Name: succinic acid O1-(1,3-dioxolan-4-ylmethyl) ester O4-[[4-(4-keto-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl] ester Formula: C28H30NO9+ MolecularWeight: 524.5391

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[N+]1(COC(=O)CCC(=O)OCC2COCO2)C3=CC(=O)C4=C(O3)C(=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1COCC[N+]1(COC(=O)CCC(=O)OCC2COCO2)C3=CC(=O)C4=C(O3)C(=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H30NO9/c30-24-15-25(38-28-22(7-4-8-23(24)28)20-5-2-1-3-6-20)29(11-13-33-14-12-29)18-36-27(32)10-9-26(31)35-17-21-16-34-19-37-21/h1-8,15,21H,9-14,16-19H2/q+1