ethyl 3-[(6-methoxy-6-oxidanylidene-hexyl)carbamoyl]-5-nitro-benzoate

Systemtic Name: ethyl 3-[(6-methoxy-6-oxidanylidene-hexyl)carbamoyl]-5-nitro-benzoate Openeye Name: ethyl 3-[(6-methoxy-6-oxo-hexyl)carbamoyl]-5-nitro-benzoate CAS Name: 3-[[(6-methoxy-6-oxohexyl)amino]-oxomethyl]-5-nitrobenzoic acid ethyl ester IUPAC Name: ethyl 3-[(6-methoxy-6-oxohexyl)carbamoyl]-5-nitrobenzoate Traditional Name: 3-[(6-keto-6-methoxy-hexyl)carbamoyl]-5-nitro-benzoic acid ethyl ester Formula: C17H22N2O7 MolecularWeight: 366.36578

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCCCCCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NCCCCCC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C17H22N2O7/c1-3-26-17(22)13-9-12(10-14(11-13)19(23)24)16(21)18-8-6-4-5-7-15(20)25-2/h9-11H,3-8H2,1-2H3,(H,18,21)