[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-methyl-6-nitro-benzoate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-methyl-6-nitro-benzoate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 2-methyl-6-nitro-benzoate CAS Name: 2-methyl-6-nitrobenzoic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 2-methyl-6-nitrobenzoate Traditional Name: 2-methyl-6-nitro-benzoic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C15H19N3O6 MolecularWeight: 337.32786

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)C1=C(C=CC=C1[N+](=O)[O-])C

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)C1=C(C=CC=C1[N+](=O)[O-])C

InChI

InChI=1S/C15H19N3O6/c1-3-4-8-16-15(21)17-12(19)9-24-14(20)13-10(2)6-5-7-11(13)18(22)23/h5-7H,3-4,8-9H2,1-2H3,(H2,16,17,19,21)