phenethyl 2-nitrobenzoate

Systemtic Name: phenethyl 2-nitrobenzoate Openeye Name: phenethyl 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid phenethyl ester IUPAC Name: phenethyl 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid phenethyl ester Formula: C15H13NO4 MolecularWeight: 271.26802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H13NO4/c17-15(13-8-4-5-9-14(13)16(18)19)20-11-10-12-6-2-1-3-7-12/h1-9H,10-11H2