2-[4-[[5,6-bis(4-methylphenyl)pyrazin-2-yl]-methyl-amino]butoxy]ethanoic acid

Systemtic Name: 2-[4-[[5,6-bis(4-methylphenyl)pyrazin-2-yl]-methyl-amino]butoxy]ethanoic acid Openeye Name: 2-[4-[[5,6-bis(p-tolyl)pyrazin-2-yl]-methyl-amino]butoxy]acetic acid CAS Name: 2-[4-[[5,6-bis(4-methylphenyl)-2-pyrazinyl]-methylamino]butoxy]acetic acid IUPAC Name: 2-[4-[[5,6-bis(4-methylphenyl)pyrazin-2-yl]-methylamino]butoxy]acetic acid Traditional Name: 2-[4-[[5,6-bis(p-tolyl)pyrazin-2-yl]-methyl-amino]butoxy]acetic acid Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC=C(N=C2C3=CC=C(C=C3)C)N(C)CCCCOCC(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC=C(N=C2C3=CC=C(C=C3)C)N(C)CCCCOCC(=O)O

InChI

InChI=1S/C25H29N3O3/c1-18-6-10-20(11-7-18)24-25(21-12-8-19(2)9-13-21)27-22(16-26-24)28(3)14-4-5-15-31-17-23(29)30/h6-13,16H,4-5,14-15,17H2,1-3H3,(H,29,30)