N-methyl-3-(2-methylpropyl)-N-[(1R)-1-(3-nitrophenyl)ethyl]-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: N-methyl-3-(2-methylpropyl)-N-[(1R)-1-(3-nitrophenyl)ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-isobutyl-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-methyl-3-(2-methylpropyl)-N-[(1R)-1-(3-nitrophenyl)ethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-methyl-3-(2-methylpropyl)-N-[(1R)-1-(3-nitrophenyl)ethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-isobutyl-4-keto-N-methyl-N-[(1R)-1-(3-nitrophenyl)ethyl]phthalazine-1-carboxamide Formula: C22H24N4O4 MolecularWeight: 408.45036

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)C(C)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)C2=NN(C(=O)C3=CC=CC=C32)CC(C)C

InChI

InChI=1S/C22H24N4O4/c1-14(2)13-25-21(27)19-11-6-5-10-18(19)20(23-25)22(28)24(4)15(3)16-8-7-9-17(12-16)26(29)30/h5-12,14-15H,13H2,1-4H3/t15-/m1/s1