ethyl 2-[5-[4-[(E)-diazanylidenemethyl]phenyl]pentanoylamino]-3-pyridin-2-yl-propanoate

Systemtic Name: ethyl 2-[5-[4-[(E)-diazanylidenemethyl]phenyl]pentanoylamino]-3-pyridin-2-yl-propanoate Openeye Name: ethyl 2-[5-[4-[(E)-hydrazinylidenemethyl]phenyl]pentanoylamino]-3-(2-pyridyl)propanoate CAS Name: 2-[[5-[4-[(E)-hydrazinylidenemethyl]phenyl]-1-oxopentyl]amino]-3-(2-pyridinyl)propanoic acid ethyl ester IUPAC Name: ethyl 2-[5-[4-[(E)-hydrazinylidenemethyl]phenyl]pentanoylamino]-3-pyridin-2-ylpropanoate Traditional Name: 2-[5-[4-[(E)-hydrazonomethyl]phenyl]pentanoylamino]-3-(2-pyridyl)propionic acid ethyl ester Formula: C22H28N4O3 MolecularWeight: 396.48272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=N1)NC(=O)CCCCC2=CC=C(C=C2)C=NN

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=N1)NC(=O)CCCCC2=CC=C(C=C2)/C=N/N

InChI

InChI=1S/C22H28N4O3/c1-2-29-22(28)20(15-19-8-5-6-14-24-19)26-21(27)9-4-3-7-17-10-12-18(13-11-17)16-25-23/h5-6,8,10-14,16,20H,2-4,7,9,15,23H2,1H3,(H,26,27)/b25-16+