tert-butyl 4-[2-[3-(2,2-dimethylpropanoyloxymethyl)-6-methoxy-4-oxidanylidene-quinazolin-7-yl]oxyethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[3-(2,2-dimethylpropanoyloxymethyl)-6-methoxy-4-oxidanylidene-quinazolin-7-yl]oxyethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-[3-(2,2-dimethylpropanoyloxymethyl)-6-methoxy-4-oxo-quinazolin-7-yl]oxyethyl]piperidine-1-carboxylate CAS Name: 4-[2-[[3-[(2,2-dimethyl-1-oxopropoxy)methyl]-6-methoxy-4-oxo-7-quinazolinyl]oxy]ethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[3-(2,2-dimethylpropanoyloxymethyl)-6-methoxy-4-oxoquinazolin-7-yl]oxyethyl]piperidine-1-carboxylate Traditional Name: 4-[2-[4-keto-6-methoxy-3-(pivaloyloxymethyl)quinazolin-7-yl]oxyethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C27H39N3O7 MolecularWeight: 517.61446

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCN1C=NC2=CC(=C(C=C2C1=O)OC)OCCC3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C(=O)OCN1C=NC2=CC(=C(C=C2C1=O)OC)OCCC3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C27H39N3O7/c1-26(2,3)24(32)36-17-30-16-28-20-15-22(21(34-7)14-19(20)23(30)31)35-13-10-18-8-11-29(12-9-18)25(33)37-27(4,5)6/h14-16,18H,8-13,17H2,1-7H3