tert-butyl 4-(6-nitro-4-phenyl-quinazolin-2-yl)piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-(6-nitro-4-phenyl-quinazolin-2-yl)piperazine-1-carboxylate Openeye Name: tert-butyl 4-(6-nitro-4-phenyl-quinazolin-2-yl)piperazine-1-carboxylate CAS Name: 4-(6-nitro-4-phenyl-2-quinazolinyl)-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(6-nitro-4-phenylquinazolin-2-yl)piperazine-1-carboxylate Traditional Name: 4-(6-nitro-4-phenyl-quinazolin-2-yl)piperazine-1-carboxylic acid tert-butyl ester Formula: C23H25N5O4 MolecularWeight: 435.4757

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=N2)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC3=C(C=C(C=C3)[N+](=O)[O-])C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C23H25N5O4/c1-23(2,3)32-22(29)27-13-11-26(12-14-27)21-24-19-10-9-17(28(30)31)15-18(19)20(25-21)16-7-5-4-6-8-16/h4-10,15H,11-14H2,1-3H3