(E)-2-azanyloxy-7-(3,5-dimethoxyphenyl)-7-methoxy-6-(4-oxidanyl-4-phenyl-piperidin-1-yl)hept-2-enoic acid

Systemtic Name: (E)-2-azanyloxy-7-(3,5-dimethoxyphenyl)-7-methoxy-6-(4-oxidanyl-4-phenyl-piperidin-1-yl)hept-2-enoic acid Openeye Name: (E)-2-aminooxy-7-(3,5-dimethoxyphenyl)-6-(4-hydroxy-4-phenyl-1-piperidyl)-7-methoxy-hept-2-enoic acid CAS Name: (E)-2-aminooxy-7-(3,5-dimethoxyphenyl)-6-(4-hydroxy-4-phenyl-1-piperidinyl)-7-methoxy-2-heptenoic acid IUPAC Name: (E)-2-aminooxy-7-(3,5-dimethoxyphenyl)-6-(4-hydroxy-4-phenylpiperidin-1-yl)-7-methoxyhept-2-enoic acid Traditional Name: (E)-2-aminooxy-7-(3,5-dimethoxyphenyl)-6-(4-hydroxy-4-phenyl-piperidino)-7-methoxy-hept-2-enoic acid Formula: C27H36N2O7 MolecularWeight: 500.58394

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(C(CCC=C(C(=O)O)ON)N2CCC(CC2)(C3=CC=CC=C3)O)OC)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(C(CC/C=C(\C(=O)O)/ON)N2CCC(CC2)(C3=CC=CC=C3)O)OC)OC

InChI

InChI=1S/C27H36N2O7/c1-33-21-16-19(17-22(18-21)34-2)25(35-3)23(10-7-11-24(36-28)26(30)31)29-14-12-27(32,13-15-29)20-8-5-4-6-9-20/h4-6,8-9,11,16-18,23,25,32H,7,10,12-15,28H2,1-3H3,(H,30,31)/b24-11+