N-[3-(2-methylpropoxy)propyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide

Systemtic Name: N-[3-(2-methylpropoxy)propyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-(3-isobutoxypropyl)-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3-(2-methylpropoxy)propyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[3-(2-methylpropoxy)propyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-(3-isobutoxypropyl)-4-keto-phthalazine-1-carboxamide Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COCCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

CC(C)COCCCNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C23H27N3O3/c1-17(2)16-29-14-8-13-24-22(27)21-19-11-6-7-12-20(19)23(28)26(25-21)15-18-9-4-3-5-10-18/h3-7,9-12,17H,8,13-16H2,1-2H3,(H,24,27)