2-[[2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]methylamino]ethanoic acid

Systemtic Name: 2-[[2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]methylamino]ethanoic acid Openeye Name: 2-[[2-[2-(2-naphthyl)ethoxy]-4-(pyrazol-1-ylmethyl)phenyl]methylamino]acetic acid CAS Name: 2-[[2-[2-(2-naphthalenyl)ethoxy]-4-(1-pyrazolylmethyl)phenyl]methylamino]acetic acid IUPAC Name: 2-[[2-(2-naphthalen-2-ylethoxy)-4-(pyrazol-1-ylmethyl)phenyl]methylamino]acetic acid Traditional Name: 2-[[2-[2-(2-naphthyl)ethoxy]-4-(pyrazol-1-ylmethyl)benzyl]amino]acetic acid Formula: C25H25N3O3 MolecularWeight: 415.4843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CCOC3=C(C=CC(=C3)CN4C=CC=N4)CNCC(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CCOC3=C(C=CC(=C3)CN4C=CC=N4)CNCC(=O)O

InChI

InChI=1S/C25H25N3O3/c29-25(30)17-26-16-23-9-7-20(18-28-12-3-11-27-28)15-24(23)31-13-10-19-6-8-21-4-1-2-5-22(21)14-19/h1-9,11-12,14-15,26H,10,13,16-18H2,(H,29,30)