imidazo[1,2-a]pyridin-2-ylmethyl 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: imidazo[1,2-a]pyridin-2-ylmethyl 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: imidazo[1,2-a]pyridin-2-ylmethyl 3-butyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-butyl-4-oxo-1-phthalazinecarboxylic acid 2-imidazo[1,2-a]pyridinylmethyl ester IUPAC Name: imidazo[1,2-a]pyridin-2-ylmethyl 3-butyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-butyl-4-keto-phthalazine-1-carboxylic acid imidazo[1,2-a]pyridin-2-ylmethyl ester Formula: C21H20N4O3 MolecularWeight: 376.4085

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CN4C=CC=CC4=N3

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OCC3=CN4C=CC=CC4=N3

InChI

InChI=1S/C21H20N4O3/c1-2-3-12-25-20(26)17-9-5-4-8-16(17)19(23-25)21(27)28-14-15-13-24-11-7-6-10-18(24)22-15/h4-11,13H,2-3,12,14H2,1H3