(2S)-2-(4,5-dimethoxy-2-nitro-phenyl)-3-(phenylmethyl)-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-2-(4,5-dimethoxy-2-nitro-phenyl)-3-(phenylmethyl)-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-3-benzyl-2-(4,5-dimethoxy-2-nitro-phenyl)-1,2-dihydroquinazolin-4-one CAS Name: (2S)-2-(4,5-dimethoxy-2-nitrophenyl)-3-(phenylmethyl)-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-3-benzyl-2-(4,5-dimethoxy-2-nitrophenyl)-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-3-benzyl-2-(4,5-dimethoxy-2-nitro-phenyl)-1,2-dihydroquinazolin-4-one Formula: C23H21N3O5 MolecularWeight: 419.42994

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)C2NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)[C@H]2NC3=CC=CC=C3C(=O)N2CC4=CC=CC=C4)[N+](=O)[O-])OC

InChI

InChI=1S/C23H21N3O5/c1-30-20-12-17(19(26(28)29)13-21(20)31-2)22-24-18-11-7-6-10-16(18)23(27)25(22)14-15-8-4-3-5-9-15/h3-13,22,24H,14H2,1-2H3/t22-/m0/s1