(5-chloranyl-2-methoxy-phenyl)methyl 4-(methylamino)-3-nitro-benzoate

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl 4-(methylamino)-3-nitro-benzoate Openeye Name: (5-chloro-2-methoxy-phenyl)methyl 4-(methylamino)-3-nitro-benzoate CAS Name: 4-(methylamino)-3-nitrobenzoic acid (5-chloro-2-methoxyphenyl)methyl ester IUPAC Name: (5-chloro-2-methoxyphenyl)methyl 4-(methylamino)-3-nitrobenzoate Traditional Name: 4-(methylamino)-3-nitro-benzoic acid (5-chloro-2-methoxy-benzyl) ester Formula: C16H15ClN2O5 MolecularWeight: 350.7537

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)OCC2=C(C=CC(=C2)Cl)OC)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)OCC2=C(C=CC(=C2)Cl)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClN2O5/c1-18-13-5-3-10(8-14(13)19(21)22)16(20)24-9-11-7-12(17)4-6-15(11)23-2/h3-8,18H,9H2,1-2H3