2-butoxyethanoic acid; N-methyl-5,6-bis(4-methylphenyl)pyrazin-2-amine

Systemtic Name: 2-butoxyethanoic acid; N-methyl-5,6-bis(4-methylphenyl)pyrazin-2-amine Openeye Name: 2-butoxyacetic acid; N-methyl-5,6-bis(p-tolyl)pyrazin-2-amine CAS Name: 2-butoxyacetic acid; N-methyl-5,6-bis(4-methylphenyl)-2-pyrazinamine IUPAC Name: 2-butoxyacetic acid; N-methyl-5,6-bis(4-methylphenyl)pyrazin-2-amine Traditional Name: [5,6-bis(p-tolyl)pyrazin-2-yl]-methyl-amine; 2-butoxyacetic acid Formula: C25H31N3O3 MolecularWeight: 421.53194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19N3.C6H12O3/c1-13-4-8-15(9-5-13)18-19(22-17(20-3)12-21-18)16-10-6-14(2)7-11-16;1-2-3-4-9-5-6(7)8/h4-12H,1-3H3,(H,20,22);2-5H2,1H3,(H,7,8)