methyl 3-(4-aminophenyl)-2-(pyridin-4-ylcarbonylamino)propanoate

Systemtic Name: methyl 3-(4-aminophenyl)-2-(pyridin-4-ylcarbonylamino)propanoate Openeye Name: methyl 3-(4-aminophenyl)-2-(pyridine-4-carbonylamino)propanoate CAS Name: 3-(4-aminophenyl)-2-[[oxo(pyridin-4-yl)methyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(4-aminophenyl)-2-(pyridine-4-carbonylamino)propanoate Traditional Name: 3-(4-aminophenyl)-2-isonicotinamido-propionic acid methyl ester Formula: C16H17N3O3 MolecularWeight: 299.32448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC=C(C=C1)N)NC(=O)C2=CC=NC=C2

Isomeric SMILES

COC(=O)C(CC1=CC=C(C=C1)N)NC(=O)C2=CC=NC=C2

InChI

InChI=1S/C16H17N3O3/c1-22-16(21)14(10-11-2-4-13(17)5-3-11)19-15(20)12-6-8-18-9-7-12/h2-9,14H,10,17H2,1H3,(H,19,20)