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

Systemtic Name: (6-bromanylnaphthalen-2-yl) 3-butyl-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: (6-bromo-2-naphthyl) 3-butyl-4-oxo-phthalazine-1-carboxylate CAS Name: 3-butyl-4-oxo-1-phthalazinecarboxylic acid (6-bromo-2-naphthalenyl) ester IUPAC Name: (6-bromonaphthalen-2-yl) 3-butyl-4-oxophthalazine-1-carboxylate Traditional Name: 3-butyl-4-keto-phthalazine-1-carboxylic acid (6-bromo-2-naphthyl) ester Formula: C23H19BrN2O3 MolecularWeight: 451.31256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)OC3=CC4=C(C=C3)C=C(C=C4)Br

InChI

InChI=1S/C23H19BrN2O3/c1-2-3-12-26-22(27)20-7-5-4-6-19(20)21(25-26)23(28)29-18-11-9-15-13-17(24)10-8-16(15)14-18/h4-11,13-14H,2-3,12H2,1H3