N-methyl-N-[(3-nitrophenyl)methyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide

Systemtic Name: N-methyl-N-[(3-nitrophenyl)methyl]-4-oxidanylidene-3-propan-2-yl-phthalazine-1-carboxamide Openeye Name: 3-isopropyl-N-methyl-N-[(3-nitrophenyl)methyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-methyl-N-[(3-nitrophenyl)methyl]-4-oxo-3-propan-2-yl-1-phthalazinecarboxamide IUPAC Name: N-methyl-N-[(3-nitrophenyl)methyl]-4-oxo-3-propan-2-ylphthalazine-1-carboxamide Traditional Name: 3-isopropyl-4-keto-N-methyl-N-(3-nitrobenzyl)phthalazine-1-carboxamide Formula: C20H20N4O4 MolecularWeight: 380.3972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)CC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)N1C(=O)C2=CC=CC=C2C(=N1)C(=O)N(C)CC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O4/c1-13(2)23-19(25)17-10-5-4-9-16(17)18(21-23)20(26)22(3)12-14-7-6-8-15(11-14)24(27)28/h4-11,13H,12H2,1-3H3