9-[6-[(4-methoxyphenyl)methylamino]pyridin-2-yl]-3-(2-methoxypyrimidin-5-yl)nonanoic acid

Systemtic Name: 9-[6-[(4-methoxyphenyl)methylamino]pyridin-2-yl]-3-(2-methoxypyrimidin-5-yl)nonanoic acid Openeye Name: 9-[6-[(4-methoxyphenyl)methylamino]-2-pyridyl]-3-(2-methoxypyrimidin-5-yl)nonanoic acid CAS Name: 9-[6-[(4-methoxyphenyl)methylamino]-2-pyridinyl]-3-(2-methoxy-5-pyrimidinyl)nonanoic acid IUPAC Name: 9-[6-[(4-methoxyphenyl)methylamino]pyridin-2-yl]-3-(2-methoxypyrimidin-5-yl)nonanoic acid Traditional Name: 3-(2-methoxypyrimidin-5-yl)-9-[6-(p-anisylamino)-2-pyridyl]pelargonic acid Formula: C27H34N4O4 MolecularWeight: 478.58326

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC2=CC=CC(=N2)CCCCCCC(CC(=O)O)C3=CN=C(N=C3)OC

Isomeric SMILES

COC1=CC=C(C=C1)CNC2=CC=CC(=N2)CCCCCCC(CC(=O)O)C3=CN=C(N=C3)OC

InChI

InChI=1S/C27H34N4O4/c1-34-24-14-12-20(13-15-24)17-28-25-11-7-10-23(31-25)9-6-4-3-5-8-21(16-26(32)33)22-18-29-27(35-2)30-19-22/h7,10-15,18-19,21H,3-6,8-9,16-17H2,1-2H3,(H,28,31)(H,32,33)