2-[(2-ethyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)amino]-2-phenyl-propanoic acid

Systemtic Name: 2-[(2-ethyl-4-oxidanylidene-4aH-quinazolin-3-ium-3-yl)amino]-2-phenyl-propanoic acid Openeye Name: 2-[(2-ethyl-4-oxo-4aH-quinazolin-3-ium-3-yl)amino]-2-phenyl-propanoic acid CAS Name: 2-[(2-ethyl-4-oxo-4aH-quinazolin-3-ium-3-yl)amino]-2-phenylpropanoic acid IUPAC Name: 2-[(2-ethyl-4-oxo-4aH-quinazolin-3-ium-3-yl)amino]-2-phenylpropanoic acid Traditional Name: 2-[(2-ethyl-4-keto-4aH-quinazolin-3-ium-3-yl)amino]-2-phenyl-propionic acid Formula: C19H20N3O3+ MolecularWeight: 338.3804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](C(=O)C2C=CC=CC2=N1)NC(C)(C3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCC1=[N+](C(=O)C2C=CC=CC2=N1)NC(C)(C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C19H19N3O3/c1-3-16-20-15-12-8-7-11-14(15)17(23)22(16)21-19(2,18(24)25)13-9-5-4-6-10-13/h4-12,14,21H,3H2,1-2H3/p+1