4-[[2-(4-oxidanylidenequinazolin-3-yl)-3-phenyl-propanoyl]amino]butanoic acid

Systemtic Name: 4-[[2-(4-oxidanylidenequinazolin-3-yl)-3-phenyl-propanoyl]amino]butanoic acid Openeye Name: 4-[[2-(4-oxoquinazolin-3-yl)-3-phenyl-propanoyl]amino]butanoic acid CAS Name: 4-[[1-oxo-2-(4-oxo-3-quinazolinyl)-3-phenylpropyl]amino]butanoic acid IUPAC Name: 4-[[2-(4-oxoquinazolin-3-yl)-3-phenylpropanoyl]amino]butanoic acid Traditional Name: 4-[[2-(4-ketoquinazolin-3-yl)-3-phenyl-propanoyl]amino]butyric acid Formula: C21H21N3O4 MolecularWeight: 379.40914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NCCCC(=O)O)N2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)NCCCC(=O)O)N2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21N3O4/c25-19(26)11-6-12-22-20(27)18(13-15-7-2-1-3-8-15)24-14-23-17-10-5-4-9-16(17)21(24)28/h1-5,7-10,14,18H,6,11-13H2,(H,22,27)(H,25,26)