2-[[4-(quinazolin-4-ylamino)phenyl]carbonylamino]ethanoate

Systemtic Name: 2-[[4-(quinazolin-4-ylamino)phenyl]carbonylamino]ethanoate Openeye Name: 2-[[4-(quinazolin-4-ylamino)benzoyl]amino]acetate CAS Name: 2-[[oxo-[4-(4-quinazolinylamino)phenyl]methyl]amino]acetate IUPAC Name: 2-[[4-(quinazolin-4-ylamino)benzoyl]amino]acetate Traditional Name: 2-[[4-(quinazolin-4-ylamino)benzoyl]amino]acetate Formula: C17H13N4O3- MolecularWeight: 321.31012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)C(=O)NCC(=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)NC3=CC=C(C=C3)C(=O)NCC(=O)[O-]

InChI

InChI=1S/C17H14N4O3/c22-15(23)9-18-17(24)11-5-7-12(8-6-11)21-16-13-3-1-2-4-14(13)19-10-20-16/h1-8,10H,9H2,(H,18,24)(H,22,23)(H,19,20,21)/p-1