methyl 4-[2-(4-aminocarbonyl-5-azanyl-pyridin-2-yl)ethyl]benzoate

Systemtic Name: methyl 4-[2-(4-aminocarbonyl-5-azanyl-pyridin-2-yl)ethyl]benzoate Openeye Name: methyl 4-[2-(5-amino-4-carbamoyl-2-pyridyl)ethyl]benzoate CAS Name: 4-[2-(5-amino-4-carbamoyl-2-pyridinyl)ethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-(5-amino-4-carbamoylpyridin-2-yl)ethyl]benzoate Traditional Name: 4-[2-(5-amino-4-carbamoyl-2-pyridyl)ethyl]benzoic acid methyl ester Formula: C16H17N3O3 MolecularWeight: 299.32448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CCC2=NC=C(C(=C2)C(=O)N)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CCC2=NC=C(C(=C2)C(=O)N)N

InChI

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