(8-methylimidazo[1,2-a]pyridin-2-yl)methyl 2-morpholin-4-yl-5-nitro-benzoate

Systemtic Name: (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 2-morpholin-4-yl-5-nitro-benzoate Openeye Name: (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 2-morpholino-5-nitro-benzoate CAS Name: 2-(4-morpholinyl)-5-nitrobenzoic acid (8-methyl-2-imidazo[1,2-a]pyridinyl)methyl ester IUPAC Name: (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 2-morpholin-4-yl-5-nitrobenzoate Traditional Name: 2-morpholino-5-nitro-benzoic acid (8-methylimidazo[1,2-a]pyridin-2-yl)methyl ester Formula: C20H20N4O5 MolecularWeight: 396.3966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C2)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4

Isomeric SMILES

CC1=CC=CN2C1=NC(=C2)COC(=O)C3=C(C=CC(=C3)[N+](=O)[O-])N4CCOCC4

InChI

InChI=1S/C20H20N4O5/c1-14-3-2-6-23-12-15(21-19(14)23)13-29-20(25)17-11-16(24(26)27)4-5-18(17)22-7-9-28-10-8-22/h2-6,11-12H,7-10,13H2,1H3