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

Systemtic Name: N-[2-(3-bromanyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-piperidin-1-yl-benzamide Openeye Name: N-[2-(3-bromo-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-(1-piperidyl)benzamide CAS Name: N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-(1-piperidinyl)benzamide IUPAC Name: N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-piperidin-1-ylbenzamide Traditional Name: N-[2-(3-bromo-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-5-nitro-2-piperidino-benzamide Formula: C26H23BrN4O5 MolecularWeight: 551.38862

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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)Br

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)Br

InChI

InChI=1S/C26H23BrN4O5/c1-35-23-9-5-16(13-20(23)27)26-29-21-14-17(6-10-24(21)36-26)28-25(32)19-15-18(31(33)34)7-8-22(19)30-11-3-2-4-12-30/h5-10,13-15H,2-4,11-12H2,1H3,(H,28,32)