(2S)-2-(4-methyl-3-nitro-phenyl)-3-prop-2-enyl-1,2-dihydroquinazolin-4-one

Systemtic Name: (2S)-2-(4-methyl-3-nitro-phenyl)-3-prop-2-enyl-1,2-dihydroquinazolin-4-one Openeye Name: (2S)-3-allyl-2-(4-methyl-3-nitro-phenyl)-1,2-dihydroquinazolin-4-one CAS Name: (2S)-2-(4-methyl-3-nitrophenyl)-3-prop-2-enyl-1,2-dihydroquinazolin-4-one IUPAC Name: (2S)-2-(4-methyl-3-nitrophenyl)-3-prop-2-enyl-1,2-dihydroquinazolin-4-one Traditional Name: (2S)-3-allyl-2-(4-methyl-3-nitro-phenyl)-1,2-dihydroquinazolin-4-one Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2NC3=CC=CC=C3C(=O)N2CC=C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H]2NC3=CC=CC=C3C(=O)N2CC=C)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3/c1-3-10-20-17(13-9-8-12(2)16(11-13)21(23)24)19-15-7-5-4-6-14(15)18(20)22/h3-9,11,17,19H,1,10H2,2H3/t17-/m0/s1