3-[5-[4-[(E)-diazanylidenemethyl]phenyl]pentanoylamino]-3-pyridin-2-yl-propanoic acid

Systemtic Name: 3-[5-[4-[(E)-diazanylidenemethyl]phenyl]pentanoylamino]-3-pyridin-2-yl-propanoic acid Openeye Name: 3-[5-[4-[(E)-hydrazinylidenemethyl]phenyl]pentanoylamino]-3-(2-pyridyl)propanoic acid CAS Name: 3-[[5-[4-[(E)-hydrazinylidenemethyl]phenyl]-1-oxopentyl]amino]-3-(2-pyridinyl)propanoic acid IUPAC Name: 3-[5-[4-[(E)-hydrazinylidenemethyl]phenyl]pentanoylamino]-3-pyridin-2-ylpropanoic acid Traditional Name: 3-[5-[4-[(E)-hydrazonomethyl]phenyl]pentanoylamino]-3-(2-pyridyl)propionic acid Formula: C20H24N4O3 MolecularWeight: 368.42956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C(CC(=O)O)NC(=O)CCCCC2=CC=C(C=C2)C=NN

Isomeric SMILES

C1=CC=NC(=C1)C(CC(=O)O)NC(=O)CCCCC2=CC=C(C=C2)/C=N/N

InChI

InChI=1S/C20H24N4O3/c21-23-14-16-10-8-15(9-11-16)5-1-2-7-19(25)24-18(13-20(26)27)17-6-3-4-12-22-17/h3-4,6,8-12,14,18H,1-2,5,7,13,21H2,(H,24,25)(H,26,27)/b23-14+