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

Systemtic Name: (2S)-2-(4,5-dimethoxy-2-nitro-phenyl)-3-propyl-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-2-(4,5-dimethoxy-2-nitro-phenyl)-3-propyl-1,2-dihydroquinazolin-4-one CAS Name: (2S)-2-(4,5-dimethoxy-2-nitrophenyl)-3-propyl-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-2-(4,5-dimethoxy-2-nitrophenyl)-3-propyl-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-2-(4,5-dimethoxy-2-nitro-phenyl)-3-propyl-1,2-dihydroquinazolin-4-one Formula: C19H21N3O5 MolecularWeight: 371.38714

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(NC2=CC=CC=C2C1=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CCCN1[C@H](NC2=CC=CC=C2C1=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C19H21N3O5/c1-4-9-21-18(20-14-8-6-5-7-12(14)19(21)23)13-10-16(26-2)17(27-3)11-15(13)22(24)25/h5-8,10-11,18,20H,4,9H2,1-3H3/t18-/m0/s1