6,7-dimethyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-quinoxalin-2-one

Systemtic Name: 6,7-dimethyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-quinoxalin-2-one Openeye Name: 6,7-dimethyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-quinoxalin-2-one CAS Name: 6,7-dimethyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-quinoxalin-2-one IUPAC Name: 6,7-dimethyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-quinoxalin-2-one Traditional Name: 6,7-dimethyl-3-[(6-nitro-1,3-benzodioxol-5-yl)methyl]-1H-quinoxalin-2-one Formula: C18H15N3O5 MolecularWeight: 353.3288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(C(=O)N2)CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(C(=O)N2)CC3=CC4=C(C=C3[N+](=O)[O-])OCO4

InChI

InChI=1S/C18H15N3O5/c1-9-3-12-13(4-10(9)2)20-18(22)14(19-12)5-11-6-16-17(26-8-25-16)7-15(11)21(23)24/h3-4,6-7H,5,8H2,1-2H3,(H,20,22)