(4R)-4-(3-nitro-4-oxidanyl-phenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one

Systemtic Name: (4R)-4-(3-nitro-4-oxidanyl-phenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one Openeye Name: (4R)-4-(4-hydroxy-3-nitro-phenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one CAS Name: (4R)-4-(4-hydroxy-3-nitrophenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one IUPAC Name: (4R)-4-(4-hydroxy-3-nitrophenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one Traditional Name: (4R)-4-(4-hydroxy-3-nitro-phenyl)-3,4,5,6-tetrahydro-1H-benzo[h]quinazolin-2-one Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C3=CC=CC=C31)NC(=O)NC2C4=CC(=C(C=C4)O)[N+](=O)[O-]

Isomeric SMILES

C1CC2=C(C3=CC=CC=C31)NC(=O)N[C@@H]2C4=CC(=C(C=C4)O)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O4/c22-15-8-6-11(9-14(15)21(24)25)16-13-7-5-10-3-1-2-4-12(10)17(13)20-18(23)19-16/h1-4,6,8-9,16,22H,5,7H2,(H2,19,20,23)/t16-/m1/s1