4-(4-oxidanylidene-1H-quinazolin-2-yl)-2-(phenylmethoxycarbonylamino)butanoic acid

Systemtic Name: 4-(4-oxidanylidene-1H-quinazolin-2-yl)-2-(phenylmethoxycarbonylamino)butanoic acid Openeye Name: 2-(benzyloxycarbonylamino)-4-(4-oxo-1H-quinazolin-2-yl)butanoic acid CAS Name: 4-(4-oxo-1H-quinazolin-2-yl)-2-(phenylmethoxycarbonylamino)butanoic acid IUPAC Name: 4-(4-oxo-1H-quinazolin-2-yl)-2-(phenylmethoxycarbonylamino)butanoic acid Traditional Name: 2-(benzyloxycarbonylamino)-4-(4-keto-1H-quinazolin-2-yl)butyric acid Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CCC2=NC(=O)C3=CC=CC=C3N2)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CCC2=NC(=O)C3=CC=CC=C3N2)C(=O)O

InChI

InChI=1S/C20H19N3O5/c24-18-14-8-4-5-9-15(14)21-17(23-18)11-10-16(19(25)26)22-20(27)28-12-13-6-2-1-3-7-13/h1-9,16H,10-12H2,(H,22,27)(H,25,26)(H,21,23,24)