[4-(2-methoxyethyl)phenyl] 3-nitrobenzoate

Systemtic Name: [4-(2-methoxyethyl)phenyl] 3-nitrobenzoate Openeye Name: [4-(2-methoxyethyl)phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-(2-methoxyethyl)phenyl] ester IUPAC Name: [4-(2-methoxyethyl)phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-(2-methoxyethyl)phenyl] ester Formula: C16H15NO5 MolecularWeight: 301.294

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Descriptors Computed from Structure

Canonical SMILES:

COCCC1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

COCCC1=CC=C(C=C1)OC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO5/c1-21-10-9-12-5-7-15(8-6-12)22-16(18)13-3-2-4-14(11-13)17(19)20/h2-8,11H,9-10H2,1H3