N-(2-dimethylaminoethyl)-4-methyl-3-nitro-benzamide

Systemtic Name: N-(2-dimethylaminoethyl)-4-methyl-3-nitro-benzamide Openeye Name: N-(2-dimethylaminoethyl)-4-methyl-3-nitro-benzamide CAS Name: N-(2-dimethylaminoethyl)-4-methyl-3-nitrobenzamide IUPAC Name: N-(2-dimethylaminoethyl)-4-methyl-3-nitrobenzamide Traditional Name: N-(2-dimethylaminoethyl)-4-methyl-3-nitro-benzamide Formula: C12H17N3O3 MolecularWeight: 251.28168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NCCN(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NCCN(C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O3/c1-9-4-5-10(8-11(9)15(17)18)12(16)13-6-7-14(2)3/h4-5,8H,6-7H2,1-3H3,(H,13,16)