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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OCCOC2=CC=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OCCOC2=CC=C(C=C2)Br)[N+](=O)[O-]

InChI

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