4-methoxy-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-N-prop-2-enyl-benzamide

Systemtic Name: 4-methoxy-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-4-methoxy-N-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-benzamide CAS Name: 4-methoxy-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-N-prop-2-enylbenzamide IUPAC Name: 4-methoxy-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-4-methoxy-N-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-benzamide Formula: C21H20N4O5 MolecularWeight: 408.4073

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NOC(=N2)CN(CC=C)C(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NOC(=N2)CN(CC=C)C(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H20N4O5/c1-4-10-24(21(26)16-8-9-18(29-3)17(12-16)25(27)28)13-19-22-20(23-30-19)15-7-5-6-14(2)11-15/h4-9,11-12H,1,10,13H2,2-3H3