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

Systemtic Name: N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[2-(2,4-dimethylphenyl)-1,3-benzoxazol-5-yl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C28H28N4O4 MolecularWeight: 484.54632

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=C(C=C5)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC4=C(C=C3)OC(=N4)C5=C(C=C(C=C5)C)C)[N+](=O)[O-]

InChI

InChI=1S/C28H28N4O4/c1-17-10-12-31(13-11-17)24-8-5-20(15-25(24)32(34)35)27(33)29-21-6-9-26-23(16-21)30-28(36-26)22-7-4-18(2)14-19(22)3/h4-9,14-17H,10-13H2,1-3H3,(H,29,33)