2-[[3-methyl-2-(4-oxidanylidenequinazolin-3-yl)butanoyl]amino]butanedioic acid

Systemtic Name: 2-[[3-methyl-2-(4-oxidanylidenequinazolin-3-yl)butanoyl]amino]butanedioic acid Openeye Name: 2-[[3-methyl-2-(4-oxoquinazolin-3-yl)butanoyl]amino]butanedioic acid CAS Name: 2-[[3-methyl-1-oxo-2-(4-oxo-3-quinazolinyl)butyl]amino]butanedioic acid IUPAC Name: 2-[[3-methyl-2-(4-oxoquinazolin-3-yl)butanoyl]amino]butanedioic acid Traditional Name: 2-[[2-(4-ketoquinazolin-3-yl)-3-methyl-butanoyl]amino]succinic acid Formula: C17H19N3O6 MolecularWeight: 361.34926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC(CC(=O)O)C(=O)O)N1C=NC2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)C(C(=O)NC(CC(=O)O)C(=O)O)N1C=NC2=CC=CC=C2C1=O

InChI

InChI=1S/C17H19N3O6/c1-9(2)14(15(23)19-12(17(25)26)7-13(21)22)20-8-18-11-6-4-3-5-10(11)16(20)24/h3-6,8-9,12,14H,7H2,1-2H3,(H,19,23)(H,21,22)(H,25,26)