4-[3-[5-[(Z)-C-methyl-N-oxidanyl-carbonimidoyl]-2-phenylmethoxy-phenyl]propyl]benzoic acid

Systemtic Name: 4-[3-[5-[(Z)-C-methyl-N-oxidanyl-carbonimidoyl]-2-phenylmethoxy-phenyl]propyl]benzoic acid Openeye Name: 4-[3-[2-benzyloxy-5-[(Z)-N-hydroxy-C-methyl-carbonimidoyl]phenyl]propyl]benzoic acid CAS Name: 4-[3-[5-[(1Z)-1-hydroxyiminoethyl]-2-phenylmethoxyphenyl]propyl]benzoic acid IUPAC Name: 4-[3-[5-[(Z)-N-hydroxy-C-methylcarbonimidoyl]-2-phenylmethoxyphenyl]propyl]benzoic acid Traditional Name: 4-[3-(5-acetohydroximoyl-2-benzoxy-phenyl)propyl]benzoic acid Formula: C25H25NO4 MolecularWeight: 403.4703

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NO)C1=CC(=C(C=C1)OCC2=CC=CC=C2)CCCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C/C(=N/O)/C1=CC(=C(C=C1)OCC2=CC=CC=C2)CCCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C25H25NO4/c1-18(26-29)22-14-15-24(30-17-20-6-3-2-4-7-20)23(16-22)9-5-8-19-10-12-21(13-11-19)25(27)28/h2-4,6-7,10-16,29H,5,8-9,17H2,1H3,(H,27,28)/b26-18-