(2S)-2-(6-nitro-1,3-benzodioxol-5-yl)-3-phenethyl-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-2-(6-nitro-1,3-benzodioxol-5-yl)-3-phenethyl-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-2-(6-nitro-1,3-benzodioxol-5-yl)-3-phenethyl-1,2-dihydroquinazolin-4-one CAS Name: (2S)-2-(6-nitro-1,3-benzodioxol-5-yl)-3-phenethyl-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-2-(6-nitro-1,3-benzodioxol-5-yl)-3-phenethyl-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-2-(6-nitro-1,3-benzodioxol-5-yl)-3-phenethyl-1,2-dihydroquinazolin-4-one Formula: C23H19N3O5 MolecularWeight: 417.41406

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C(=C2)C3NC4=CC=CC=C4C(=O)N3CCC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1OC2=C(O1)C=C(C(=C2)[C@H]3NC4=CC=CC=C4C(=O)N3CCC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H19N3O5/c27-23-16-8-4-5-9-18(16)24-22(25(23)11-10-15-6-2-1-3-7-15)17-12-20-21(31-14-30-20)13-19(17)26(28)29/h1-9,12-13,22,24H,10-11,14H2/t22-/m0/s1