methyl 3-[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[(5-chloranyl-2-methoxy-phenyl)methyl-methyl-carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[(5-chloro-2-methoxy-phenyl)methyl-methyl-carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(5-chloro-2-methoxyphenyl)methyl-methylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[(5-chloro-2-methoxyphenyl)methyl-methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[(5-chloro-2-methoxy-benzyl)-methyl-carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C18H17ClN2O6 MolecularWeight: 392.79038

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Cl)OC)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Cl)OC)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H17ClN2O6/c1-20(10-13-7-14(19)4-5-16(13)26-2)17(22)11-6-12(18(23)27-3)9-15(8-11)21(24)25/h4-9H,10H2,1-3H3