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

Systemtic Name: 2-chloranyl-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-4-nitro-aniline Openeye Name: 2-chloro-N-methyl-N-[(5-methylisoxazol-3-yl)methyl]-4-nitro-aniline CAS Name: 2-chloro-N-methyl-N-[(5-methyl-3-isoxazolyl)methyl]-4-nitroaniline IUPAC Name: 2-chloro-N-methyl-N-[(5-methyl-1,2-oxazol-3-yl)methyl]-4-nitroaniline Traditional Name: (2-chloro-4-nitro-phenyl)-methyl-[(5-methylisoxazol-3-yl)methyl]amine Formula: C12H12ClN3O3 MolecularWeight: 281.69498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)CN(C)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC(=NO1)CN(C)C2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C12H12ClN3O3/c1-8-5-9(14-19-8)7-15(2)12-4-3-10(16(17)18)6-11(12)13/h3-6H,7H2,1-2H3