2-azanylethanoic acid; 4-methyl-2-nitro-3-phenylmethoxy-benzamide

Systemtic Name: 2-azanylethanoic acid; 4-methyl-2-nitro-3-phenylmethoxy-benzamide Openeye Name: 2-aminoacetic acid; 3-benzyloxy-4-methyl-2-nitro-benzamide CAS Name: 2-aminoacetic acid; 4-methyl-2-nitro-3-phenylmethoxybenzamide IUPAC Name: 2-aminoacetic acid; 4-methyl-2-nitro-3-phenylmethoxybenzamide Traditional Name: 2-aminoacetic acid; 3-benzoxy-4-methyl-2-nitro-benzamide Formula: C17H19N3O6 MolecularWeight: 361.34926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)N)[N+](=O)[O-])OCC2=CC=CC=C2.C(C(=O)O)N

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)N)[N+](=O)[O-])OCC2=CC=CC=C2.C(C(=O)O)N

InChI

InChI=1S/C15H14N2O4.C2H5NO2/c1-10-7-8-12(15(16)18)13(17(19)20)14(10)21-9-11-5-3-2-4-6-11;3-1-2(4)5/h2-8H,9H2,1H3,(H2,16,18);1,3H2,(H,4,5)