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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-piperidino-benzamide Formula: C27H26N4O6 MolecularWeight: 502.51854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])N5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])N5CCCCC5)OC

InChI

InChI=1S/C27H26N4O6/c1-35-24-10-6-17(14-25(24)36-2)27-29-21-15-18(7-11-23(21)37-27)28-26(32)20-16-19(31(33)34)8-9-22(20)30-12-4-3-5-13-30/h6-11,14-16H,3-5,12-13H2,1-2H3,(H,28,32)