(2Z)-2-[(4-ethylphenyl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-6-oxidanyl-1-benzofuran-3-one

Systemtic Name: (2Z)-2-[(4-ethylphenyl)methylidene]-7-(morpholin-4-ium-4-ylmethyl)-6-oxidanyl-1-benzofuran-3-one Openeye Name: (2Z)-2-[(4-ethylphenyl)methylene]-6-hydroxy-7-(morpholin-4-ium-4-ylmethyl)benzofuran-3-one CAS Name: (2Z)-2-[(4-ethylphenyl)methylidene]-6-hydroxy-7-(4-morpholin-4-iumylmethyl)-3-benzofuranone IUPAC Name: (2Z)-2-[(4-ethylphenyl)methylidene]-6-hydroxy-7-(morpholin-4-ium-4-ylmethyl)-1-benzofuran-3-one Traditional Name: (2Z)-2-(4-ethylbenzylidene)-6-hydroxy-7-(morpholin-4-ium-4-ylmethyl)coumaran-3-one Formula: C22H24NO4+ MolecularWeight: 366.43026

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=C2C(=O)C3=C(O2)C(=C(C=C3)O)C[NH+]4CCOCC4

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C\2/C(=O)C3=C(O2)C(=C(C=C3)O)C[NH+]4CCOCC4

InChI

InChI=1S/C22H23NO4/c1-2-15-3-5-16(6-4-15)13-20-21(25)17-7-8-19(24)18(22(17)27-20)14-23-9-11-26-12-10-23/h3-8,13,24H,2,9-12,14H2,1H3/p+1/b20-13-