[2-(4-methoxyphenyl)-6-oxidanyl-chromen-4-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [2-(4-methoxyphenyl)-6-oxidanyl-chromen-4-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [6-hydroxy-2-(4-methoxyphenyl)-1-benzopyran-4-ylidene]-methyl-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [6-hydroxy-2-(4-methoxyphenyl)chromen-4-ylidene]-methyl-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C23H28N2O3+2 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[N+](=C2C=C(OC3=C2C=C(C=C3)O)C4=CC=C(C=C4)OC)C

Isomeric SMILES

C[NH+]1CCC(CC1)[N+](=C2C=C(OC3=C2C=C(C=C3)O)C4=CC=C(C=C4)OC)C

InChI

InChI=1S/C23H26N2O3/c1-24-12-10-17(11-13-24)25(2)21-15-23(16-4-7-19(27-3)8-5-16)28-22-9-6-18(26)14-20(21)22/h4-9,14-15,17H,10-13H2,1-3H3/p+2