2-imidazol-1-ylethyl 3-methyl-5-nitro-2-phenyl-quinoline-4-carboxylate

Systemtic Name: 2-imidazol-1-ylethyl 3-methyl-5-nitro-2-phenyl-quinoline-4-carboxylate Openeye Name: 2-imidazol-1-ylethyl 3-methyl-5-nitro-2-phenyl-quinoline-4-carboxylate CAS Name: 3-methyl-5-nitro-2-phenyl-4-quinolinecarboxylic acid 2-(1-imidazolyl)ethyl ester IUPAC Name: 2-imidazol-1-ylethyl 3-methyl-5-nitro-2-phenylquinoline-4-carboxylate Traditional Name: 3-methyl-5-nitro-2-phenyl-cinchoninic acid 2-imidazol-1-ylethyl ester Formula: C22H18N4O4 MolecularWeight: 402.40272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C2C=CC=C(C2=C1C(=O)OCCN3C=CN=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C2C=CC=C(C2=C1C(=O)OCCN3C=CN=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

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