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

Systemtic Name: N-methyl-3-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl]-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-methyl-3-[2-(3-nitroanilino)-2-oxo-ethyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-methyl-3-[2-(3-nitroanilino)-2-oxoethyl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-methyl-3-[2-(3-nitroanilino)-2-oxoethyl]-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-[2-keto-2-(3-nitroanilino)ethyl]-N-methyl-phthalazine-1-carboxamide Formula: C18H15N5O5 MolecularWeight: 381.3422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)CC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H15N5O5/c1-19-17(25)16-13-7-2-3-8-14(13)18(26)22(21-16)10-15(24)20-11-5-4-6-12(9-11)23(27)28/h2-9H,10H2,1H3,(H,19,25)(H,20,24)