2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 2-phenylquinoline-4-carboxylate

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 2-phenylquinoline-4-carboxylate Openeye Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 2-phenylquinoline-4-carboxylate CAS Name: 2-phenyl-4-quinolinecarboxylic acid 2-(2-methyl-5-nitro-1-imidazolyl)ethyl ester IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethyl 2-phenylquinoline-4-carboxylate Traditional Name: 2-phenylcinchoninic acid 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl ester Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H18N4O4/c1-15-23-14-21(26(28)29)25(15)11-12-30-22(27)18-13-20(16-7-3-2-4-8-16)24-19-10-6-5-9-17(18)19/h2-10,13-14H,11-12H2,1H3