methyl 4-[[4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-phenyl]carbonylamino]butanoate

Systemtic Name: methyl 4-[[4-(4-chloranyl-2-nitro-phenoxy)-3-methoxy-phenyl]carbonylamino]butanoate Openeye Name: methyl 4-[[4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoyl]amino]butanoate CAS Name: 4-[[[4-(4-chloro-2-nitrophenoxy)-3-methoxyphenyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[[4-(4-chloro-2-nitrophenoxy)-3-methoxybenzoyl]amino]butanoate Traditional Name: 4-[[4-(4-chloro-2-nitro-phenoxy)-3-methoxy-benzoyl]amino]butyric acid methyl ester Formula: C19H19ClN2O7 MolecularWeight: 422.81636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NCCCC(=O)OC)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NCCCC(=O)OC)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN2O7/c1-27-17-10-12(19(24)21-9-3-4-18(23)28-2)5-7-16(17)29-15-8-6-13(20)11-14(15)22(25)26/h5-8,10-11H,3-4,9H2,1-2H3,(H,21,24)