ethyl 3-[ethyl-[2-(methylamino)-2-oxidanylidene-ethyl]carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[ethyl-[2-(methylamino)-2-oxidanylidene-ethyl]carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[ethyl-[2-(methylamino)-2-oxo-ethyl]carbamoyl]-5-nitro-benzoate CAS Name: 3-[[ethyl-[2-(methylamino)-2-oxoethyl]amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[ethyl-[2-(methylamino)-2-oxoethyl]carbamoyl]-5-nitrobenzoate Traditional Name: 3-[ethyl-[2-keto-2-(methylamino)ethyl]carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C15H19N3O6 MolecularWeight: 337.32786

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC)C(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC

Isomeric SMILES

CCN(CC(=O)NC)C(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC

InChI

InChI=1S/C15H19N3O6/c1-4-17(9-13(19)16-3)14(20)10-6-11(15(21)24-5-2)8-12(7-10)18(22)23/h6-8H,4-5,9H2,1-3H3,(H,16,19)