2-(2-methylphenoxy)ethyl 4-bromanyl-3-nitro-benzoate

Systemtic Name: 2-(2-methylphenoxy)ethyl 4-bromanyl-3-nitro-benzoate Openeye Name: 2-(2-methylphenoxy)ethyl 4-bromo-3-nitro-benzoate CAS Name: 4-bromo-3-nitrobenzoic acid 2-(2-methylphenoxy)ethyl ester IUPAC Name: 2-(2-methylphenoxy)ethyl 4-bromo-3-nitrobenzoate Traditional Name: 4-bromo-3-nitro-benzoic acid 2-(2-methylphenoxy)ethyl ester Formula: C16H14BrNO5 MolecularWeight: 380.19006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCCOC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1OCCOC(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H14BrNO5/c1-11-4-2-3-5-15(11)22-8-9-23-16(19)12-6-7-13(17)14(10-12)18(20)21/h2-7,10H,8-9H2,1H3