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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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