ethyl 3-nitro-5-[[3-(oxolan-2-ylmethoxy)phenyl]carbamoyl]benzoate

Systemtic Name: ethyl 3-nitro-5-[[3-(oxolan-2-ylmethoxy)phenyl]carbamoyl]benzoate Openeye Name: ethyl 3-nitro-5-[[3-(tetrahydrofuran-2-ylmethoxy)phenyl]carbamoyl]benzoate CAS Name: 3-nitro-5-[oxo-[3-(2-oxolanylmethoxy)anilino]methyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-nitro-5-[[3-(oxolan-2-ylmethoxy)phenyl]carbamoyl]benzoate Traditional Name: 3-nitro-5-[[3-(tetrahydrofurfuryloxy)phenyl]carbamoyl]benzoic acid ethyl ester Formula: C21H22N2O7 MolecularWeight: 414.40858

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC(=CC=C2)OCC3CCCO3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1)C(=O)NC2=CC(=CC=C2)OCC3CCCO3)[N+](=O)[O-]

InChI

InChI=1S/C21H22N2O7/c1-2-28-21(25)15-9-14(10-17(11-15)23(26)27)20(24)22-16-5-3-6-18(12-16)30-13-19-7-4-8-29-19/h3,5-6,9-12,19H,2,4,7-8,13H2,1H3,(H,22,24)