4-[3-(1,3-benzoxazol-2-yl)-4-nitro-4,5-dihydro-1,2-oxazol-5-yl]-N,N-dimethyl-aniline

Systemtic Name: 4-[3-(1,3-benzoxazol-2-yl)-4-nitro-4,5-dihydro-1,2-oxazol-5-yl]-N,N-dimethyl-aniline Openeye Name: 4-[3-(1,3-benzoxazol-2-yl)-4-nitro-4,5-dihydroisoxazol-5-yl]-N,N-dimethyl-aniline CAS Name: 4-[3-(1,3-benzoxazol-2-yl)-4-nitro-4,5-dihydroisoxazol-5-yl]-N,N-dimethylaniline IUPAC Name: 4-[3-(1,3-benzoxazol-2-yl)-4-nitro-4,5-dihydro-1,2-oxazol-5-yl]-N,N-dimethylaniline Traditional Name: [4-[3-(1,3-benzoxazol-2-yl)-4-nitro-2-isoxazolin-5-yl]phenyl]-dimethyl-amine Formula: C18H16N4O4 MolecularWeight: 352.34404

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C2C(C(=NO2)C3=NC4=CC=CC=C4O3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C2C(C(=NO2)C3=NC4=CC=CC=C4O3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N4O4/c1-21(2)12-9-7-11(8-10-12)17-16(22(23)24)15(20-26-17)18-19-13-5-3-4-6-14(13)25-18/h3-10,16-17H,1-2H3