2-[[3-(aminocarbonylamino)phenyl]carbonylamino]ethanoyl 3-(2-azanylpyridin-3-yl)propanoate

Systemtic Name: 2-[[3-(aminocarbonylamino)phenyl]carbonylamino]ethanoyl 3-(2-azanylpyridin-3-yl)propanoate Openeye Name: [2-[(3-ureidobenzoyl)amino]acetyl] 3-(2-amino-3-pyridyl)propanoate CAS Name: 3-(2-amino-3-pyridinyl)propanoic acid [2-[[[3-(carbamoylamino)phenyl]-oxomethyl]amino]-1-oxoethyl] ester IUPAC Name: [2-[[3-(carbamoylamino)benzoyl]amino]acetyl] 3-(2-aminopyridin-3-yl)propanoate Traditional Name: 3-(2-amino-3-pyridyl)propionic acid [2-[(3-ureidobenzoyl)amino]acetyl] ester Formula: C18H19N5O5 MolecularWeight: 385.37396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)N)C(=O)NCC(=O)OC(=O)CCC2=C(N=CC=C2)N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)N)C(=O)NCC(=O)OC(=O)CCC2=C(N=CC=C2)N

InChI

InChI=1S/C18H19N5O5/c19-16-11(4-2-8-21-16)6-7-14(24)28-15(25)10-22-17(26)12-3-1-5-13(9-12)23-18(20)27/h1-5,8-9H,6-7,10H2,(H2,19,21)(H,22,26)(H3,20,23,27)