2-[3-[2-[(5,6-diphenylpyrazin-2-yl)-methyl-amino]ethyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[2-[(5,6-diphenylpyrazin-2-yl)-methyl-amino]ethyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[2-[(5,6-diphenylpyrazin-2-yl)-methyl-amino]ethyl]phenoxy]acetic acid CAS Name: 2-[3-[2-[(5,6-diphenyl-2-pyrazinyl)-methylamino]ethyl]phenoxy]acetic acid IUPAC Name: 2-[3-[2-[(5,6-diphenylpyrazin-2-yl)-methylamino]ethyl]phenoxy]acetic acid Traditional Name: 2-[3-[2-[(5,6-diphenylpyrazin-2-yl)-methyl-amino]ethyl]phenoxy]acetic acid Formula: C27H25N3O3 MolecularWeight: 439.5057

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=CC=C1)OCC(=O)O)C2=CN=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(CCC1=CC(=CC=C1)OCC(=O)O)C2=CN=C(C(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C27H25N3O3/c1-30(16-15-20-9-8-14-23(17-20)33-19-25(31)32)24-18-28-26(21-10-4-2-5-11-21)27(29-24)22-12-6-3-7-13-22/h2-14,17-18H,15-16,19H2,1H3,(H,31,32)