2-[7-acetamido-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]butanedioic acid

Systemtic Name: 2-[7-acetamido-2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]butanedioic acid Openeye Name: 2-(7-acetamido-2,4-dioxo-1H-quinazolin-3-yl)butanedioic acid CAS Name: 2-(7-acetamido-2,4-dioxo-1H-quinazolin-3-yl)butanedioic acid IUPAC Name: 2-(7-acetamido-2,4-dioxo-1H-quinazolin-3-yl)butanedioic acid Traditional Name: 2-(7-acetamido-2,4-diketo-1H-quinazolin-3-yl)succinic acid Formula: C14H13N3O7 MolecularWeight: 335.26892

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C(=O)N(C(=O)N2)C(CC(=O)O)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C(=O)N(C(=O)N2)C(CC(=O)O)C(=O)O

InChI

InChI=1S/C14H13N3O7/c1-6(18)15-7-2-3-8-9(4-7)16-14(24)17(12(8)21)10(13(22)23)5-11(19)20/h2-4,10H,5H2,1H3,(H,15,18)(H,16,24)(H,19,20)(H,22,23)