methyl 3-[[2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]-5-nitro-benzoate

Systemtic Name: methyl 3-[[2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]-methyl-carbamoyl]-5-nitro-benzoate Openeye Name: methyl 3-[[2-(3,4-dichloroanilino)-2-oxo-ethyl]-methyl-carbamoyl]-5-nitro-benzoate CAS Name: 3-[[[2-(3,4-dichloroanilino)-2-oxoethyl]-methylamino]-oxomethyl]-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 3-[[2-(3,4-dichloroanilino)-2-oxoethyl]-methylcarbamoyl]-5-nitrobenzoate Traditional Name: 3-[[2-(3,4-dichloroanilino)-2-keto-ethyl]-methyl-carbamoyl]-5-nitro-benzoic acid methyl ester Formula: C18H15Cl2N3O6 MolecularWeight: 440.2342

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC(=C(C=C1)Cl)Cl)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CN(CC(=O)NC1=CC(=C(C=C1)Cl)Cl)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C18H15Cl2N3O6/c1-22(9-16(24)21-12-3-4-14(19)15(20)8-12)17(25)10-5-11(18(26)29-2)7-13(6-10)23(27)28/h3-8H,9H2,1-2H3,(H,21,24)