(2S)-3-(2-methoxyphenyl)-2-(3-nitro-4-oxidanyl-phenyl)-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-3-(2-methoxyphenyl)-2-(3-nitro-4-oxidanyl-phenyl)-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-2-(4-hydroxy-3-nitro-phenyl)-3-(2-methoxyphenyl)-1,2-dihydroquinazolin-4-one CAS Name: (2S)-2-(4-hydroxy-3-nitrophenyl)-3-(2-methoxyphenyl)-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-2-(4-hydroxy-3-nitrophenyl)-3-(2-methoxyphenyl)-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-2-(4-hydroxy-3-nitro-phenyl)-3-(2-methoxyphenyl)-1,2-dihydroquinazolin-4-one Formula: C21H17N3O5 MolecularWeight: 391.37678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(NC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)O)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2[C@H](NC3=CC=CC=C3C2=O)C4=CC(=C(C=C4)O)[N+](=O)[O-]

InChI

InChI=1S/C21H17N3O5/c1-29-19-9-5-4-8-16(19)23-20(13-10-11-18(25)17(12-13)24(27)28)22-15-7-3-2-6-14(15)21(23)26/h2-12,20,22,25H,1H3/t20-/m0/s1