(4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-(tert-butoxycarbonylamino)benzoate CAS Name: 4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]benzoic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 4-[(2-methylpropan-2-yl)oxycarbonylamino]benzoate Traditional Name: 4-(tert-butoxycarbonylamino)benzoic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)OCC2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=C(C=C1)C(=O)OCC2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C21H21N3O5/c1-21(2,3)29-20(27)22-14-10-8-13(9-11-14)19(26)28-12-17-23-16-7-5-4-6-15(16)18(25)24-17/h4-11H,12H2,1-3H3,(H,22,27)(H,23,24,25)