butyl 4-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]benzoate

Systemtic Name: butyl 4-[(4-oxidanylidene-3-propyl-phthalazin-1-yl)carbonylamino]benzoate Openeye Name: butyl 4-[(4-oxo-3-propyl-phthalazine-1-carbonyl)amino]benzoate CAS Name: 4-[[oxo-(4-oxo-3-propyl-1-phthalazinyl)methyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(4-oxo-3-propylphthalazine-1-carbonyl)amino]benzoate Traditional Name: 4-[(4-keto-3-propyl-phthalazine-1-carbonyl)amino]benzoic acid butyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CCC

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=NN(C(=O)C3=CC=CC=C32)CCC

InChI

InChI=1S/C23H25N3O4/c1-3-5-15-30-23(29)16-10-12-17(13-11-16)24-21(27)20-18-8-6-7-9-19(18)22(28)26(25-20)14-4-2/h6-13H,3-5,14-15H2,1-2H3,(H,24,27)