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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-3-methyl-4-nitro-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-3-methyl-4-nitro-benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-3-methyl-4-nitrobenzamide Traditional Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-3-methyl-4-nitro-benzamide Formula: C23H19N3O6 MolecularWeight: 433.41346

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19N3O6/c1-13-10-14(4-7-18(13)26(28)29)22(27)24-16-6-9-19-17(12-16)25-23(32-19)15-5-8-20(30-2)21(11-15)31-3/h4-12H,1-3H3,(H,24,27)