(2Z)-4-methyl-7-(morpholin-4-ium-4-ylmethyl)-6-oxidanyl-2-(pyridin-4-ylmethylidene)-1-benzofuran-3-one

Systemtic Name: (2Z)-4-methyl-7-(morpholin-4-ium-4-ylmethyl)-6-oxidanyl-2-(pyridin-4-ylmethylidene)-1-benzofuran-3-one Openeye Name: (2Z)-6-hydroxy-4-methyl-7-(morpholin-4-ium-4-ylmethyl)-2-(4-pyridylmethylene)benzofuran-3-one CAS Name: (2Z)-6-hydroxy-4-methyl-7-(4-morpholin-4-iumylmethyl)-2-(pyridin-4-ylmethylidene)-3-benzofuranone IUPAC Name: (2Z)-6-hydroxy-4-methyl-7-(morpholin-4-ium-4-ylmethyl)-2-(pyridin-4-ylmethylidene)-1-benzofuran-3-one Traditional Name: (2Z)-6-hydroxy-4-methyl-7-(morpholin-4-ium-4-ylmethyl)-2-(4-pyridylmethylene)coumaran-3-one Formula: C20H21N2O4+ MolecularWeight: 353.39174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)C(=CC3=CC=NC=C3)O2)C[NH+]4CCOCC4)O

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)/C(=C/C3=CC=NC=C3)/O2)C[NH+]4CCOCC4)O

InChI

InChI=1S/C20H20N2O4/c1-13-10-16(23)15(12-22-6-8-25-9-7-22)20-18(13)19(24)17(26-20)11-14-2-4-21-5-3-14/h2-5,10-11,23H,6-9,12H2,1H3/p+1/b17-11-