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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-yl-benzamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-piperidyl)benzamide CAS Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-(1-piperidinyl)benzamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-piperidin-1-ylbenzamide Traditional Name: N-[2-(3,4-dimethoxyphenyl)-1,3-benzoxazol-5-yl]-3-nitro-4-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=CC(=C(C=C4)N5CCCCC5)[N+](=O)[O-])OC

Isomeric SMILES

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

InChI

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