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

Systemtic Name: 2-(3-methylphenoxy)ethyl 4-chloranyl-3-nitro-benzoate Openeye Name: 2-(3-methylphenoxy)ethyl 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid 2-(3-methylphenoxy)ethyl ester IUPAC Name: 2-(3-methylphenoxy)ethyl 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid 2-(3-methylphenoxy)ethyl ester Formula: C16H14ClNO5 MolecularWeight: 335.73906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClNO5/c1-11-3-2-4-13(9-11)22-7-8-23-16(19)12-5-6-14(17)15(10-12)18(20)21/h2-6,9-10H,7-8H2,1H3