tert-butyl 4-[[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-(3-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(3-methoxyphenyl)-4-oxo-quinazolin-2-yl]methyl]piperazine-1-carboxylate CAS Name: 4-[[3-(3-methoxyphenyl)-4-oxo-2-quinazolinyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-(3-methoxyphenyl)-4-oxoquinazolin-2-yl]methyl]piperazine-1-carboxylate Traditional Name: 4-[[4-keto-3-(3-methoxyphenyl)quinazolin-2-yl]methyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C25H30N4O4 MolecularWeight: 450.5301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC2=NC3=CC=CC=C3C(=O)N2C4=CC(=CC=C4)OC

InChI

InChI=1S/C25H30N4O4/c1-25(2,3)33-24(31)28-14-12-27(13-15-28)17-22-26-21-11-6-5-10-20(21)23(30)29(22)18-8-7-9-19(16-18)32-4/h5-11,16H,12-15,17H2,1-4H3