1-hexyl-4-[[4-(pyridin-2-ylamino)phenyl]methyl]piperazine-2,3-dione

Systemtic Name: 1-hexyl-4-[[4-(pyridin-2-ylamino)phenyl]methyl]piperazine-2,3-dione Openeye Name: 1-hexyl-4-[[4-(2-pyridylamino)phenyl]methyl]piperazine-2,3-dione CAS Name: 1-hexyl-4-[[4-(2-pyridinylamino)phenyl]methyl]piperazine-2,3-dione IUPAC Name: 1-hexyl-4-[[4-(pyridin-2-ylamino)phenyl]methyl]piperazine-2,3-dione Traditional Name: 1-hexyl-4-[4-(2-pyridylamino)benzyl]piperazine-2,3-quinone Formula: C22H28N4O2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCN(C(=O)C1=O)CC2=CC=C(C=C2)NC3=CC=CC=N3

Isomeric SMILES

CCCCCCN1CCN(C(=O)C1=O)CC2=CC=C(C=C2)NC3=CC=CC=N3

InChI

InChI=1S/C22H28N4O2/c1-2-3-4-7-14-25-15-16-26(22(28)21(25)27)17-18-9-11-19(12-10-18)24-20-8-5-6-13-23-20/h5-6,8-13H,2-4,7,14-17H2,1H3,(H,23,24)