methyl 3-[(5-chloranyl-2-nitro-phenyl)methyl-methyl-amino]propanoate

Systemtic Name: methyl 3-[(5-chloranyl-2-nitro-phenyl)methyl-methyl-amino]propanoate Openeye Name: methyl 3-[(5-chloro-2-nitro-phenyl)methyl-methyl-amino]propanoate CAS Name: 3-[(5-chloro-2-nitrophenyl)methyl-methylamino]propanoic acid methyl ester IUPAC Name: methyl 3-[(5-chloro-2-nitrophenyl)methyl-methylamino]propanoate Traditional Name: 3-[(5-chloro-2-nitro-benzyl)-methyl-amino]propionic acid methyl ester Formula: C12H15ClN2O4 MolecularWeight: 286.7115

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC(=O)OC)CC1=C(C=CC(=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(CCC(=O)OC)CC1=C(C=CC(=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H15ClN2O4/c1-14(6-5-12(16)19-2)8-9-7-10(13)3-4-11(9)15(17)18/h3-4,7H,5-6,8H2,1-2H3