[2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-propyl-azanium

Systemtic Name: [2-[(2-methoxyphenyl)amino]-2-oxidanylidene-ethyl]-[(7-oxidanyl-2-oxidanylidene-chromen-4-yl)methyl]-propyl-azanium Openeye Name: (7-hydroxy-2-oxo-chromen-4-yl)methyl-[2-(2-methoxyanilino)-2-oxo-ethyl]-propyl-ammonium CAS Name: (7-hydroxy-2-oxo-1-benzopyran-4-yl)methyl-[2-(2-methoxyanilino)-2-oxoethyl]-propylammonium IUPAC Name: (7-hydroxy-2-oxochromen-4-yl)methyl-[2-(2-methoxyanilino)-2-oxoethyl]-propylazanium Traditional Name: (7-hydroxy-2-keto-chromen-4-yl)methyl-[2-keto-2-(o-anisidino)ethyl]-propyl-ammonium Formula: C22H25N2O5+ MolecularWeight: 397.4443

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CC1=CC(=O)OC2=C1C=CC(=C2)O)CC(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CCC[NH+](CC1=CC(=O)OC2=C1C=CC(=C2)O)CC(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C22H24N2O5/c1-3-10-24(14-21(26)23-18-6-4-5-7-19(18)28-2)13-15-11-22(27)29-20-12-16(25)8-9-17(15)20/h4-9,11-12,25H,3,10,13-14H2,1-2H3,(H,23,26)/p+1