2-[[4-[3-(2-azanyl-4-oxidanylidene-1H-quinazolin-6-yl)propyl]phenyl]carbonylamino]pentanedioic acid

Systemtic Name: 2-[[4-[3-(2-azanyl-4-oxidanylidene-1H-quinazolin-6-yl)propyl]phenyl]carbonylamino]pentanedioic acid Openeye Name: 2-[[4-[3-(2-amino-4-oxo-1H-quinazolin-6-yl)propyl]benzoyl]amino]pentanedioic acid CAS Name: 2-[[[4-[3-(2-amino-4-oxo-1H-quinazolin-6-yl)propyl]phenyl]-oxomethyl]amino]pentanedioic acid IUPAC Name: 2-[[4-[3-(2-amino-4-oxo-1H-quinazolin-6-yl)propyl]benzoyl]amino]pentanedioic acid Traditional Name: 2-[[4-[3-(2-amino-4-keto-1H-quinazolin-6-yl)propyl]benzoyl]amino]glutaric acid Formula: C23H24N4O6 MolecularWeight: 452.45986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC2=CC3=C(C=C2)NC(=NC3=O)N)C(=O)NC(CCC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CCCC2=CC3=C(C=C2)NC(=NC3=O)N)C(=O)NC(CCC(=O)O)C(=O)O

InChI

InChI=1S/C23H24N4O6/c24-23-26-17-9-6-14(12-16(17)21(31)27-23)3-1-2-13-4-7-15(8-5-13)20(30)25-18(22(32)33)10-11-19(28)29/h4-9,12,18H,1-3,10-11H2,(H,25,30)(H,28,29)(H,32,33)(H3,24,26,27,31)