butanoyl 4-(2-methylimidazo[4,5-c]pyridin-1-yl)benzoate

Systemtic Name: butanoyl 4-(2-methylimidazo[4,5-c]pyridin-1-yl)benzoate Openeye Name: butanoyl 4-(2-methylimidazo[4,5-c]pyridin-1-yl)benzoate CAS Name: 4-(2-methyl-1-imidazo[4,5-c]pyridinyl)benzoic acid 1-oxobutyl ester IUPAC Name: butanoyl 4-(2-methylimidazo[4,5-c]pyridin-1-yl)benzoate Traditional Name: 4-(2-methylimidazo[4,5-c]pyridin-1-yl)benzoic acid butyryl ester Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC(=O)C1=CC=C(C=C1)N2C(=NC3=C2C=CN=C3)C

Isomeric SMILES

CCCC(=O)OC(=O)C1=CC=C(C=C1)N2C(=NC3=C2C=CN=C3)C

InChI

InChI=1S/C18H17N3O3/c1-3-4-17(22)24-18(23)13-5-7-14(8-6-13)21-12(2)20-15-11-19-10-9-16(15)21/h5-11H,3-4H2,1-2H3