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

Systemtic Name: N-(2-azanylethyl)-3-methyl-4-nitro-benzamide Openeye Name: N-(2-aminoethyl)-3-methyl-4-nitro-benzamide CAS Name: N-(2-aminoethyl)-3-methyl-4-nitrobenzamide IUPAC Name: N-(2-aminoethyl)-3-methyl-4-nitrobenzamide Traditional Name: N-(2-aminoethyl)-3-methyl-4-nitro-benzamide Formula: C10H13N3O3 MolecularWeight: 223.22852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13N3O3/c1-7-6-8(10(14)12-5-4-11)2-3-9(7)13(15)16/h2-3,6H,4-5,11H2,1H3,(H,12,14)