2-[[4-[1-(4-oxidanylidene-1H-quinazolin-6-yl)propan-2-ylamino]phenyl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[4-[1-(4-oxidanylidene-1H-quinazolin-6-yl)propan-2-ylamino]phenyl]carbonylamino]pentanedioic acid Openeye Name: 2-[[4-[[1-methyl-2-(4-oxo-1H-quinazolin-6-yl)ethyl]amino]benzoyl]amino]pentanedioic acid CAS Name: 2-[[oxo-[4-[1-(4-oxo-1H-quinazolin-6-yl)propan-2-ylamino]phenyl]methyl]amino]pentanedioic acid IUPAC Name: 2-[[4-[1-(4-oxo-1H-quinazolin-6-yl)propan-2-ylamino]benzoyl]amino]pentanedioic acid Traditional Name: 2-[[4-[[2-(4-keto-1H-quinazolin-6-yl)-1-methyl-ethyl]amino]benzoyl]amino]glutaric acid Formula: C23H24N4O6 MolecularWeight: 452.45986

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC2=C(C=C1)NC=NC2=O)NC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

CC(CC1=CC2=C(C=C1)NC=NC2=O)NC3=CC=C(C=C3)C(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C23H24N4O6/c1-13(10-14-2-7-18-17(11-14)22(31)25-12-24-18)26-16-5-3-15(4-6-16)21(30)27-19(23(32)33)8-9-20(28)29/h2-7,11-13,19,26H,8-10H2,1H3,(H,27,30)(H,28,29)(H,32,33)(H,24,25,31)