ethyl 9-(methylamino)-1-oxidanyl-4-(phenylcarbonyl)quinolizin-5-ium-2-carboxylate

Systemtic Name: ethyl 9-(methylamino)-1-oxidanyl-4-(phenylcarbonyl)quinolizin-5-ium-2-carboxylate Openeye Name: ethyl 4-benzoyl-1-hydroxy-9-(methylamino)quinolizin-5-ium-2-carboxylate CAS Name: 4-benzoyl-1-hydroxy-9-(methylamino)-2-quinolizin-5-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 4-benzoyl-1-hydroxy-9-(methylamino)quinolizin-5-ium-2-carboxylate Traditional Name: 4-benzoyl-1-hydroxy-9-(methylamino)quinolizin-5-ium-2-carboxylic acid ethyl ester Formula: C20H19N2O4+ MolecularWeight: 351.37586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC=[N+]2C(=C1)C(=O)C3=CC=CC=C3)NC)O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC=[N+]2C(=C1)C(=O)C3=CC=CC=C3)NC)O

InChI

InChI=1S/C20H18N2O4/c1-3-26-20(25)14-12-16(18(23)13-8-5-4-6-9-13)22-11-7-10-15(21-2)17(22)19(14)24/h4-12H,3H2,1-2H3,(H-,21,23,24,25)/p+1