2-chloranyl-N-cyclopropyl-N-[[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-4-nitro-benzamide

Systemtic Name: 2-chloranyl-N-cyclopropyl-N-[[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-4-nitro-benzamide Openeye Name: 2-chloro-N-cyclopropyl-N-[[5-(2-methoxyphenyl)isoxazol-3-yl]methyl]-4-nitro-benzamide CAS Name: 2-chloro-N-cyclopropyl-N-[[5-(2-methoxyphenyl)-3-isoxazolyl]methyl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-cyclopropyl-N-[[5-(2-methoxyphenyl)-1,2-oxazol-3-yl]methyl]-4-nitrobenzamide Traditional Name: 2-chloro-N-cyclopropyl-N-[[5-(2-methoxyphenyl)isoxazol-3-yl]methyl]-4-nitro-benzamide Formula: C21H18ClN3O5 MolecularWeight: 427.83772

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=CC(=NO2)CN(C3CC3)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=CC=CC=C1C2=CC(=NO2)CN(C3CC3)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C21H18ClN3O5/c1-29-19-5-3-2-4-17(19)20-10-13(23-30-20)12-24(14-6-7-14)21(26)16-9-8-15(25(27)28)11-18(16)22/h2-5,8-11,14H,6-7,12H2,1H3