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

Systemtic Name: N-[2-(3-bromanyl-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-2-(4-methylpiperidin-1-yl)-5-nitro-benzamide Openeye Name: N-[2-(3-bromo-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-2-(4-methyl-1-piperidyl)-5-nitro-benzamide CAS Name: N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-2-(4-methyl-1-piperidinyl)-5-nitrobenzamide IUPAC Name: N-[2-(3-bromo-4-methoxyphenyl)-1,3-benzoxazol-5-yl]-2-(4-methylpiperidin-1-yl)-5-nitrobenzamide Traditional Name: N-[2-(3-bromo-4-methoxy-phenyl)-1,3-benzoxazol-5-yl]-2-(4-methylpiperidino)-5-nitro-benzamide Formula: C27H25BrN4O5 MolecularWeight: 565.4152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H25BrN4O5/c1-16-9-11-31(12-10-16)23-6-5-19(32(34)35)15-20(23)26(33)29-18-4-8-25-22(14-18)30-27(37-25)17-3-7-24(36-2)21(28)13-17/h3-8,13-16H,9-12H2,1-2H3,(H,29,33)