5-methyl-6-[3-nitro-4-[(phenylmethyl)amino]phenyl]-1,2-diazinan-3-one

Systemtic Name: 5-methyl-6-[3-nitro-4-[(phenylmethyl)amino]phenyl]-1,2-diazinan-3-one Openeye Name: 6-[4-(benzylamino)-3-nitro-phenyl]-5-methyl-hexahydropyridazin-3-one CAS Name: 5-methyl-6-[3-nitro-4-[(phenylmethyl)amino]phenyl]-3-diazinanone IUPAC Name: 6-[4-(benzylamino)-3-nitrophenyl]-5-methyldiazinan-3-one Traditional Name: 6-[4-(benzylamino)-3-nitro-phenyl]-5-methyl-hexahydropyridazin-3-one Formula: C18H20N4O3 MolecularWeight: 340.3764

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NNC1C2=CC(=C(C=C2)NCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1CC(=O)NNC1C2=CC(=C(C=C2)NCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O3/c1-12-9-17(23)20-21-18(12)14-7-8-15(16(10-14)22(24)25)19-11-13-5-3-2-4-6-13/h2-8,10,12,18-19,21H,9,11H2,1H3,(H,20,23)