tert-butyl 4-[(7-oxidanyl-4-oxidanylidene-1H-quinazolin-6-yl)oxy]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(7-oxidanyl-4-oxidanylidene-1H-quinazolin-6-yl)oxy]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(7-hydroxy-4-oxo-1H-quinazolin-6-yl)oxy]piperidine-1-carboxylate CAS Name: 4-[(7-hydroxy-4-oxo-1H-quinazolin-6-yl)oxy]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(7-hydroxy-4-oxo-1H-quinazolin-6-yl)oxy]piperidine-1-carboxylate Traditional Name: 4-[(7-hydroxy-4-keto-1H-quinazolin-6-yl)oxy]piperidine-1-carboxylic acid tert-butyl ester Formula: C18H23N3O5 MolecularWeight: 361.39232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)OC2=C(C=C3C(=C2)C(=O)N=CN3)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)OC2=C(C=C3C(=C2)C(=O)N=CN3)O

InChI

InChI=1S/C18H23N3O5/c1-18(2,3)26-17(24)21-6-4-11(5-7-21)25-15-8-12-13(9-14(15)22)19-10-20-16(12)23/h8-11,22H,4-7H2,1-3H3,(H,19,20,23)