[2,6-bis(chloranyl)phenyl]methyl 2-azanyl-3-(3-nitro-4-oxidanyl-phenyl)propanoate

Systemtic Name: [2,6-bis(chloranyl)phenyl]methyl 2-azanyl-3-(3-nitro-4-oxidanyl-phenyl)propanoate Openeye Name: (2,6-dichlorophenyl)methyl 2-amino-3-(4-hydroxy-3-nitro-phenyl)propanoate CAS Name: 2-amino-3-(4-hydroxy-3-nitrophenyl)propanoic acid (2,6-dichlorophenyl)methyl ester IUPAC Name: (2,6-dichlorophenyl)methyl 2-amino-3-(4-hydroxy-3-nitrophenyl)propanoate Traditional Name: 2-amino-3-(4-hydroxy-3-nitro-phenyl)propionic acid (2,6-dichlorobenzyl) ester Formula: C16H14Cl2N2O5 MolecularWeight: 385.19876

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)COC(=O)C(CC2=CC(=C(C=C2)O)[N+](=O)[O-])N)Cl

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)COC(=O)C(CC2=CC(=C(C=C2)O)[N+](=O)[O-])N)Cl

InChI

InChI=1S/C16H14Cl2N2O5/c17-11-2-1-3-12(18)10(11)8-25-16(22)13(19)6-9-4-5-15(21)14(7-9)20(23)24/h1-5,7,13,21H,6,8,19H2