2-cinnamylidene-6-oxidanyl-7-(piperidin-1-ium-1-ylmethyl)-1-benzofuran-3-one

Systemtic Name: 2-cinnamylidene-6-oxidanyl-7-(piperidin-1-ium-1-ylmethyl)-1-benzofuran-3-one Openeye Name: 2-cinnamylidene-6-hydroxy-7-(piperidin-1-ium-1-ylmethyl)benzofuran-3-one CAS Name: 2-cinnamylidene-6-hydroxy-7-(1-piperidin-1-iumylmethyl)-3-benzofuranone IUPAC Name: 2-cinnamylidene-6-hydroxy-7-(piperidin-1-ium-1-ylmethyl)-1-benzofuran-3-one Traditional Name: 2-cinnamylidene-6-hydroxy-7-(piperidin-1-ium-1-ylmethyl)coumaran-3-one Formula: C23H24NO3+ MolecularWeight: 362.44156

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CC2=C(C=CC3=C2OC(=CC=CC4=CC=CC=C4)C3=O)O

Isomeric SMILES

C1CC[NH+](CC1)CC2=C(C=CC3=C2OC(=CC=CC4=CC=CC=C4)C3=O)O

InChI

InChI=1S/C23H23NO3/c25-20-13-12-18-22(26)21(11-7-10-17-8-3-1-4-9-17)27-23(18)19(20)16-24-14-5-2-6-15-24/h1,3-4,7-13,25H,2,5-6,14-16H2/p+1