N-[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitro-benzamide

Systemtic Name: N-[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitro-benzamide Openeye Name: N-[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitro-benzamide CAS Name: N-[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitrobenzamide IUPAC Name: N-[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitrobenzamide Traditional Name: N-[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]-4-methyl-3,5-dinitro-benzamide Formula: C23H19N5O6 MolecularWeight: 461.42686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=CC=C(C=C4)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C23H19N5O6/c1-13-19(27(30)31)10-15(11-20(13)28(32)33)22(29)24-16-6-9-21-18(12-16)25-23(34-21)14-4-7-17(8-5-14)26(2)3/h4-12H,1-3H3,(H,24,29)