(2R)-3-[(2R)-butan-2-yl]-2-(3-nitro-4-oxidanyl-phenyl)-1,2-dihydroquinazolin-4-one

Systemtic Name: (2R)-3-[(2R)-butan-2-yl]-2-(3-nitro-4-oxidanyl-phenyl)-1,2-dihydroquinazolin-4-one Openeye Name: (2R)-2-(4-hydroxy-3-nitro-phenyl)-3-[(1R)-1-methylpropyl]-1,2-dihydroquinazolin-4-one CAS Name: (2R)-3-[(2R)-butan-2-yl]-2-(4-hydroxy-3-nitrophenyl)-1,2-dihydroquinazolin-4-one IUPAC Name: (2R)-3-[(2R)-butan-2-yl]-2-(4-hydroxy-3-nitrophenyl)-1,2-dihydroquinazolin-4-one Traditional Name: (2R)-2-(4-hydroxy-3-nitro-phenyl)-3-[(1R)-1-methylpropyl]-1,2-dihydroquinazolin-4-one Formula: C18H19N3O4 MolecularWeight: 341.36116

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C(NC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

CC[C@@H](C)N1[C@@H](NC2=CC=CC=C2C1=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C18H19N3O4/c1-3-11(2)20-17(12-8-9-16(22)15(10-12)21(24)25)19-14-7-5-4-6-13(14)18(20)23/h4-11,17,19,22H,3H2,1-2H3/t11-,17-/m1/s1