4-(1H-benzimidazol-2-ylmethyl)-2,2-dimethyl-3-nitro-3H-1,4-benzoxazine

Systemtic Name: 4-(1H-benzimidazol-2-ylmethyl)-2,2-dimethyl-3-nitro-3H-1,4-benzoxazine Openeye Name: 4-(1H-benzimidazol-2-ylmethyl)-2,2-dimethyl-3-nitro-3H-1,4-benzoxazine CAS Name: 4-(1H-benzimidazol-2-ylmethyl)-2,2-dimethyl-3-nitro-3H-1,4-benzoxazine IUPAC Name: 4-(1H-benzimidazol-2-ylmethyl)-2,2-dimethyl-3-nitro-3H-1,4-benzoxazine Traditional Name: 4-(1H-benzimidazol-2-ylmethyl)-2,2-dimethyl-3-nitro-3H-1,4-benzoxazine Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(C2=CC=CC=C2O1)CC3=NC4=CC=CC=C4N3)[N+](=O)[O-])C

Isomeric SMILES

CC1(C(N(C2=CC=CC=C2O1)CC3=NC4=CC=CC=C4N3)[N+](=O)[O-])C

InChI

InChI=1S/C18H18N4O3/c1-18(2)17(22(23)24)21(14-9-5-6-10-15(14)25-18)11-16-19-12-7-3-4-8-13(12)20-16/h3-10,17H,11H2,1-2H3,(H,19,20)