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

Systemtic Name: 4-chloranyl-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-N-prop-2-enyl-benzamide Openeye Name: N-allyl-4-chloro-N-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-N-prop-2-enylbenzamide IUPAC Name: 4-chloro-N-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-N-prop-2-enylbenzamide Traditional Name: N-allyl-4-chloro-N-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methyl]-3-nitro-benzamide Formula: C20H17ClN4O4 MolecularWeight: 412.82638

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17ClN4O4/c1-3-9-24(20(26)15-7-8-16(21)17(11-15)25(27)28)12-18-22-19(23-29-18)14-6-4-5-13(2)10-14/h3-8,10-11H,1,9,12H2,2H3