(8-methylimidazo[1,2-a]pyridin-2-yl)methyl 4-(3-methylpiperidin-1-yl)-3-nitro-benzoate

Systemtic Name: (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 4-(3-methylpiperidin-1-yl)-3-nitro-benzoate Openeye Name: (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 4-(3-methyl-1-piperidyl)-3-nitro-benzoate CAS Name: 4-(3-methyl-1-piperidinyl)-3-nitrobenzoic acid (8-methyl-2-imidazo[1,2-a]pyridinyl)methyl ester IUPAC Name: (8-methylimidazo[1,2-a]pyridin-2-yl)methyl 4-(3-methylpiperidin-1-yl)-3-nitrobenzoate Traditional Name: 4-(3-methylpiperidino)-3-nitro-benzoic acid (8-methylimidazo[1,2-a]pyridin-2-yl)methyl ester Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)OCC3=CN4C=CC=C(C4=N3)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C2=C(C=C(C=C2)C(=O)OCC3=CN4C=CC=C(C4=N3)C)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O4/c1-15-5-3-9-24(12-15)19-8-7-17(11-20(19)26(28)29)22(27)30-14-18-13-25-10-4-6-16(2)21(25)23-18/h4,6-8,10-11,13,15H,3,5,9,12,14H2,1-2H3