(6-bromanylnaphthalen-2-yl) 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate

Systemtic Name: (6-bromanylnaphthalen-2-yl) 4-oxidanylidene-3-propyl-phthalazine-1-carboxylate Openeye Name: (6-bromo-2-naphthyl) 4-oxo-3-propyl-phthalazine-1-carboxylate CAS Name: 4-oxo-3-propyl-1-phthalazinecarboxylic acid (6-bromo-2-naphthalenyl) ester IUPAC Name: (6-bromonaphthalen-2-yl) 4-oxo-3-propylphthalazine-1-carboxylate Traditional Name: 4-keto-3-propyl-phthalazine-1-carboxylic acid (6-bromo-2-naphthyl) ester Formula: C22H17BrN2O3 MolecularWeight: 437.28598

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br

InChI

InChI=1S/C22H17BrN2O3/c1-2-11-25-21(26)19-6-4-3-5-18(19)20(24-25)22(27)28-17-10-8-14-12-16(23)9-7-15(14)13-17/h3-10,12-13H,2,11H2,1H3