2-[(4-cyanophenyl)amino]-2-[5-ethoxy-2-fluoranyl-3-(1-methylpiperidin-3-yl)oxy-phenyl]ethanoic acid

Systemtic Name: 2-[(4-cyanophenyl)amino]-2-[5-ethoxy-2-fluoranyl-3-(1-methylpiperidin-3-yl)oxy-phenyl]ethanoic acid Openeye Name: 2-(4-cyanoanilino)-2-[5-ethoxy-2-fluoro-3-[(1-methyl-3-piperidyl)oxy]phenyl]acetic acid CAS Name: 2-(4-cyanoanilino)-2-[5-ethoxy-2-fluoro-3-[(1-methyl-3-piperidinyl)oxy]phenyl]acetic acid IUPAC Name: 2-(4-cyanoanilino)-2-[5-ethoxy-2-fluoro-3-(1-methylpiperidin-3-yl)oxyphenyl]acetic acid Traditional Name: 2-(4-cyanoanilino)-2-[5-ethoxy-2-fluoro-3-[(1-methyl-3-piperidyl)oxy]phenyl]acetic acid Formula: C23H26FN3O4 MolecularWeight: 427.468643

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C(=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)F)OC3CCCN(C3)C

Isomeric SMILES

CCOC1=CC(=C(C(=C1)C(C(=O)O)NC2=CC=C(C=C2)C#N)F)OC3CCCN(C3)C

InChI

InChI=1S/C23H26FN3O4/c1-3-30-18-11-19(21(24)20(12-18)31-17-5-4-10-27(2)14-17)22(23(28)29)26-16-8-6-15(13-25)7-9-16/h6-9,11-12,17,22,26H,3-5,10,14H2,1-2H3,(H,28,29)