methyl 2-azanylethanoate; 4-methyl-2-nitro-3-phenylmethoxy-benzamide

Systemtic Name: methyl 2-azanylethanoate; 4-methyl-2-nitro-3-phenylmethoxy-benzamide Openeye Name: 3-benzyloxy-4-methyl-2-nitro-benzamide; methyl 2-aminoacetate CAS Name: 2-aminoacetic acid methyl ester; 4-methyl-2-nitro-3-phenylmethoxybenzamide IUPAC Name: methyl 2-aminoacetate; 4-methyl-2-nitro-3-phenylmethoxybenzamide Traditional Name: 2-aminoacetic acid methyl ester; 3-benzoxy-4-methyl-2-nitro-benzamide Formula: C18H21N3O6 MolecularWeight: 375.37584

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.COC(=O)CN

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O4.C3H7NO2/c1-10-7-8-12(15(16)18)13(17(19)20)14(10)21-9-11-5-3-2-4-6-11;1-6-3(5)2-4/h2-8H,9H2,1H3,(H2,16,18);2,4H2,1H3