sodium 2-[4-[(5,6-diphenylpyrazin-2-yl)-methyl-amino]butoxy]ethanoate

Systemtic Name: sodium 2-[4-[(5,6-diphenylpyrazin-2-yl)-methyl-amino]butoxy]ethanoate Openeye Name: sodium 2-[4-[(5,6-diphenylpyrazin-2-yl)-methyl-amino]butoxy]acetate CAS Name: sodium 2-[4-[(5,6-diphenyl-2-pyrazinyl)-methylamino]butoxy]acetate IUPAC Name: sodium 2-[4-[(5,6-diphenylpyrazin-2-yl)-methylamino]butoxy]acetate Traditional Name: sodium 2-[4-[(5,6-diphenylpyrazin-2-yl)-methyl-amino]butoxy]acetate Formula: C23H24N3NaO3 MolecularWeight: 413.44473

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCCOCC(=O)[O-])C1=CN=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3.[Na+]

Isomeric SMILES

CN(CCCCOCC(=O)[O-])C1=CN=C(C(=N1)C2=CC=CC=C2)C3=CC=CC=C3.[Na+]

InChI

InChI=1S/C23H25N3O3.Na/c1-26(14-8-9-15-29-17-21(27)28)20-16-24-22(18-10-4-2-5-11-18)23(25-20)19-12-6-3-7-13-19;/h2-7,10-13,16H,8-9,14-15,17H2,1H3,(H,27,28);/q;+1/p-1