ethyl 1-oxidanyl-3-oxidanylidene-2-(phenylmethyl)-5H-pyrido[1,2-a]benzimidazole-4-carboxylate

Systemtic Name: ethyl 1-oxidanyl-3-oxidanylidene-2-(phenylmethyl)-5H-pyrido[1,2-a]benzimidazole-4-carboxylate Openeye Name: ethyl 2-benzyl-1-hydroxy-3-oxo-5H-pyrido[1,2-a]benzimidazole-4-carboxylate CAS Name: 1-hydroxy-3-oxo-2-(phenylmethyl)-5H-pyrido[1,2-a]benzimidazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 2-benzyl-1-hydroxy-3-oxo-5H-pyrido[1,2-a]benzimidazole-4-carboxylate Traditional Name: 2-benzyl-1-hydroxy-3-keto-5H-pyrido[1,2-a]benzimidazole-4-carboxylic acid ethyl ester Formula: C21H18N2O4 MolecularWeight: 362.37862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2NC3=CC=CC=C3N2C(=C(C1=O)CC4=CC=CC=C4)O

Isomeric SMILES

CCOC(=O)C1=C2NC3=CC=CC=C3N2C(=C(C1=O)CC4=CC=CC=C4)O

InChI

InChI=1S/C21H18N2O4/c1-2-27-21(26)17-18(24)14(12-13-8-4-3-5-9-13)20(25)23-16-11-7-6-10-15(16)22-19(17)23/h3-11,22,25H,2,12H2,1H3