3-[3-(2-hydroxyphenyl)-3-[(4-methoxyphenyl)amino]propanoyl]-1-methyl-2-oxidanyl-3H-quinolin-1-ium-4-one

Systemtic Name: 3-[3-(2-hydroxyphenyl)-3-[(4-methoxyphenyl)amino]propanoyl]-1-methyl-2-oxidanyl-3H-quinolin-1-ium-4-one Openeye Name: 2-hydroxy-3-[3-(2-hydroxyphenyl)-3-(4-methoxyanilino)propanoyl]-1-methyl-3H-quinolin-1-ium-4-one CAS Name: 2-hydroxy-3-[3-(2-hydroxyphenyl)-3-(4-methoxyanilino)-1-oxopropyl]-1-methyl-3H-quinolin-1-ium-4-one IUPAC Name: 2-hydroxy-3-[3-(2-hydroxyphenyl)-3-(4-methoxyanilino)propanoyl]-1-methyl-3H-quinolin-1-ium-4-one Traditional Name: 2-hydroxy-3-[3-(2-hydroxyphenyl)-3-(p-anisidino)propanoyl]-1-methyl-3H-quinolin-1-ium-4-one Formula: C26H25N2O5+ MolecularWeight: 445.4871

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(C(C(=O)C2=CC=CC=C21)C(=O)CC(C3=CC=CC=C3O)NC4=CC=C(C=C4)OC)O

Isomeric SMILES

C[N+]1=C(C(C(=O)C2=CC=CC=C21)C(=O)CC(C3=CC=CC=C3O)NC4=CC=C(C=C4)OC)O

InChI

InChI=1S/C26H24N2O5/c1-28-21-9-5-3-8-19(21)25(31)24(26(28)32)23(30)15-20(18-7-4-6-10-22(18)29)27-16-11-13-17(33-2)14-12-16/h3-14,20,24,27,29H,15H2,1-2H3/p+1