2-[3-(2-methoxyphenyl)prop-2-enylidene]-6-oxidanyl-7-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-3-one

Systemtic Name: 2-[3-(2-methoxyphenyl)prop-2-enylidene]-6-oxidanyl-7-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-3-one Openeye Name: 6-hydroxy-2-[3-(2-methoxyphenyl)prop-2-enylidene]-7-(pyrrolidin-1-ium-1-ylmethyl)benzofuran-3-one CAS Name: 6-hydroxy-2-[3-(2-methoxyphenyl)prop-2-enylidene]-7-(1-pyrrolidin-1-iumylmethyl)-3-benzofuranone IUPAC Name: 6-hydroxy-2-[3-(2-methoxyphenyl)prop-2-enylidene]-7-(pyrrolidin-1-ium-1-ylmethyl)-1-benzofuran-3-one Traditional Name: 6-hydroxy-2-[3-(2-methoxyphenyl)prop-2-enylidene]-7-(pyrrolidin-1-ium-1-ylmethyl)coumaran-3-one Formula: C23H24NO4+ MolecularWeight: 378.44096

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=CC=C2C(=O)C3=C(O2)C(=C(C=C3)O)C[NH+]4CCCC4

Isomeric SMILES

COC1=CC=CC=C1C=CC=C2C(=O)C3=C(O2)C(=C(C=C3)O)C[NH+]4CCCC4

InChI

InChI=1S/C23H23NO4/c1-27-20-9-3-2-7-16(20)8-6-10-21-22(26)17-11-12-19(25)18(23(17)28-21)15-24-13-4-5-14-24/h2-3,6-12,25H,4-5,13-15H2,1H3/p+1