N-[2-methyl-1-(6-nitro-3-oxidanyl-4-oxidanylidene-quinazolin-2-yl)propyl]pyrrolidine-2-carboxamide

Systemtic Name: N-[2-methyl-1-(6-nitro-3-oxidanyl-4-oxidanylidene-quinazolin-2-yl)propyl]pyrrolidine-2-carboxamide Openeye Name: N-[1-(3-hydroxy-6-nitro-4-oxo-quinazolin-2-yl)-2-methyl-propyl]pyrrolidine-2-carboxamide CAS Name: N-[1-(3-hydroxy-6-nitro-4-oxo-2-quinazolinyl)-2-methylpropyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[1-(3-hydroxy-6-nitro-4-oxoquinazolin-2-yl)-2-methylpropyl]pyrrolidine-2-carboxamide Traditional Name: N-[1-(3-hydroxy-4-keto-6-nitro-quinazolin-2-yl)-2-methyl-propyl]pyrrolidine-2-carboxamide Formula: C17H21N5O5 MolecularWeight: 375.37914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1O)NC(=O)C3CCCN3

Isomeric SMILES

CC(C)C(C1=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)N1O)NC(=O)C3CCCN3

InChI

InChI=1S/C17H21N5O5/c1-9(2)14(20-16(23)13-4-3-7-18-13)15-19-12-6-5-10(22(26)27)8-11(12)17(24)21(15)25/h5-6,8-9,13-14,18,25H,3-4,7H2,1-2H3,(H,20,23)