4-[[2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-3-phenyl-propanoyl]amino]butanoic acid

Systemtic Name: 4-[[2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-3-phenyl-propanoyl]amino]butanoic acid Openeye Name: 4-[[2-(2,4-dioxo-1H-quinazolin-3-yl)-3-phenyl-propanoyl]amino]butanoic acid CAS Name: 4-[[2-(2,4-dioxo-1H-quinazolin-3-yl)-1-oxo-3-phenylpropyl]amino]butanoic acid IUPAC Name: 4-[[2-(2,4-dioxo-1H-quinazolin-3-yl)-3-phenylpropanoyl]amino]butanoic acid Traditional Name: 4-[[2-(2,4-diketo-1H-quinazolin-3-yl)-3-phenyl-propanoyl]amino]butyric acid Formula: C21H21N3O5 MolecularWeight: 395.40854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCCCC(=O)O)N2C(=O)C3=CC=CC=C3NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NCCCC(=O)O)N2C(=O)C3=CC=CC=C3NC2=O

InChI

InChI=1S/C21H21N3O5/c25-18(26)11-6-12-22-19(27)17(13-14-7-2-1-3-8-14)24-20(28)15-9-4-5-10-16(15)23-21(24)29/h1-5,7-10,17H,6,11-13H2,(H,22,27)(H,23,29)(H,25,26)