3-[3-[(4-aminophenyl)amino]-3-(furan-2-yl)propanoyl]-1-methyl-2-oxidanyl-3H-quinolin-1-ium-4-one

Systemtic Name: 3-[3-[(4-aminophenyl)amino]-3-(furan-2-yl)propanoyl]-1-methyl-2-oxidanyl-3H-quinolin-1-ium-4-one Openeye Name: 3-[3-(4-aminoanilino)-3-(2-furyl)propanoyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one CAS Name: 3-[3-(4-aminoanilino)-3-(2-furanyl)-1-oxopropyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one IUPAC Name: 3-[3-(4-aminoanilino)-3-(furan-2-yl)propanoyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one Traditional Name: 3-[3-(4-aminoanilino)-3-(2-furyl)propanoyl]-2-hydroxy-1-methyl-3H-quinolin-1-ium-4-one Formula: C23H22N3O4+ MolecularWeight: 404.43848

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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=CO3)NC4=CC=C(C=C4)N)O

Isomeric SMILES

C[N+]1=C(C(C(=O)C2=CC=CC=C21)C(=O)CC(C3=CC=CO3)NC4=CC=C(C=C4)N)O

InChI

InChI=1S/C23H21N3O4/c1-26-18-6-3-2-5-16(18)22(28)21(23(26)29)19(27)13-17(20-7-4-12-30-20)25-15-10-8-14(24)9-11-15/h2-12,17,21,25H,13,24H2,1H3/p+1