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

Systemtic Name: N-[2-(2-chloranyl-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[2-(2-chloro-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[2-(2-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[2-(2-chloro-4-methylphenyl)-1,3-benzoxazol-5-yl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[2-(2-chloro-4-methyl-phenyl)-1,3-benzoxazol-5-yl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C27H25ClN4O4 MolecularWeight: 504.9648

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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)Cl)[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)Cl)[N+](=O)[O-]

InChI

InChI=1S/C27H25ClN4O4/c1-16-9-11-31(12-10-16)23-7-4-18(14-24(23)32(34)35)26(33)29-19-5-8-25-22(15-19)30-27(36-25)20-6-3-17(2)13-21(20)28/h3-8,13-16H,9-12H2,1-2H3,(H,29,33)