[4-(4-oxidanylidene-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl 4-(3-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl)benzoate

Systemtic Name: [4-(4-oxidanylidene-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl 4-(3-methyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl)benzoate Openeye Name: [4-(4-oxo-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl 4-(3-methyl-5-oxo-2-thioxo-imidazolidin-1-yl)benzoate CAS Name: 4-(3-methyl-5-oxo-2-sulfanylidene-1-imidazolidinyl)benzoic acid [4-(4-oxo-8-phenyl-1-benzopyran-2-yl)-4-morpholin-4-iumyl]methyl ester IUPAC Name: [4-(4-oxo-8-phenylchromen-2-yl)morpholin-4-ium-4-yl]methyl 4-(3-methyl-5-oxo-2-sulfanylideneimidazolidin-1-yl)benzoate Traditional Name: 4-(5-keto-3-methyl-2-thioxo-imidazolidin-1-yl)benzoic acid [4-(4-keto-8-phenyl-chromen-2-yl)morpholin-4-ium-4-yl]methyl ester Formula: C31H28N3O6S+ MolecularWeight: 570.63552

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=O)N(C1=S)C2=CC=C(C=C2)C(=O)OC[N+]3(CCOCC3)C4=CC(=O)C5=C(O4)C(=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CN1CC(=O)N(C1=S)C2=CC=C(C=C2)C(=O)OC[N+]3(CCOCC3)C4=CC(=O)C5=C(O4)C(=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H28N3O6S/c1-32-19-27(36)33(31(32)41)23-12-10-22(11-13-23)30(37)39-20-34(14-16-38-17-15-34)28-18-26(35)25-9-5-8-24(29(25)40-28)21-6-3-2-4-7-21/h2-13,18H,14-17,19-20H2,1H3/q+1