2-(phenylcarbonyloxy)ethyl 3-methyl-4-nitro-benzoate

Systemtic Name: 2-(phenylcarbonyloxy)ethyl 3-methyl-4-nitro-benzoate Openeye Name: 2-benzoyloxyethyl 3-methyl-4-nitro-benzoate CAS Name: 3-methyl-4-nitrobenzoic acid 2-benzoyloxyethyl ester IUPAC Name: 2-benzoyloxyethyl 3-methyl-4-nitrobenzoate Traditional Name: 3-methyl-4-nitro-benzoic acid 2-benzoyloxyethyl ester Formula: C17H15NO6 MolecularWeight: 329.3041

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCCOC(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OCCOC(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H15NO6/c1-12-11-14(7-8-15(12)18(21)22)17(20)24-10-9-23-16(19)13-5-3-2-4-6-13/h2-8,11H,9-10H2,1H3