2-[2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]propanoylamino]butanedioic acid

Systemtic Name: 2-[2-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]propanoylamino]butanedioic acid Openeye Name: 2-[2-(2,4-dioxo-1H-quinazolin-3-yl)propanoylamino]butanedioic acid CAS Name: 2-[[2-(2,4-dioxo-1H-quinazolin-3-yl)-1-oxopropyl]amino]butanedioic acid IUPAC Name: 2-[2-(2,4-dioxo-1H-quinazolin-3-yl)propanoylamino]butanedioic acid Traditional Name: 2-[2-(2,4-diketo-1H-quinazolin-3-yl)propanoylamino]succinic acid Formula: C15H15N3O7 MolecularWeight: 349.2955

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(CC(=O)O)C(=O)O)N1C(=O)C2=CC=CC=C2NC1=O

Isomeric SMILES

CC(C(=O)NC(CC(=O)O)C(=O)O)N1C(=O)C2=CC=CC=C2NC1=O

InChI

InChI=1S/C15H15N3O7/c1-7(12(21)16-10(14(23)24)6-11(19)20)18-13(22)8-4-2-3-5-9(8)17-15(18)25/h2-5,7,10H,6H2,1H3,(H,16,21)(H,17,25)(H,19,20)(H,23,24)