2-(4-nitrophenyl)-3-(phenylmethyl)-6-prop-1-en-2-yl-2H-1,3,5-oxadiazin-4-one

Systemtic Name: 2-(4-nitrophenyl)-3-(phenylmethyl)-6-prop-1-en-2-yl-2H-1,3,5-oxadiazin-4-one Openeye Name: 3-benzyl-6-isopropenyl-2-(4-nitrophenyl)-2H-1,3,5-oxadiazin-4-one CAS Name: 6-(1-methylethenyl)-2-(4-nitrophenyl)-3-(phenylmethyl)-2H-1,3,5-oxadiazin-4-one IUPAC Name: 3-benzyl-2-(4-nitrophenyl)-6-prop-1-en-2-yl-2H-1,3,5-oxadiazin-4-one Traditional Name: 3-benzyl-6-isopropenyl-2-(4-nitrophenyl)-2H-1,3,5-oxadiazin-4-one Formula: C19H17N3O4 MolecularWeight: 351.35598

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1=NC(=O)N(C(O1)C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

CC(=C)C1=NC(=O)N(C(O1)C2=CC=C(C=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C19H17N3O4/c1-13(2)17-20-19(23)21(12-14-6-4-3-5-7-14)18(26-17)15-8-10-16(11-9-15)22(24)25/h3-11,18H,1,12H2,2H3