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

Systemtic Name: 2-(2-methylphenoxy)ethyl 4-methyl-3-nitro-benzoate Openeye Name: 2-(2-methylphenoxy)ethyl 4-methyl-3-nitro-benzoate CAS Name: 4-methyl-3-nitrobenzoic acid 2-(2-methylphenoxy)ethyl ester IUPAC Name: 2-(2-methylphenoxy)ethyl 4-methyl-3-nitrobenzoate Traditional Name: 4-methyl-3-nitro-benzoic acid 2-(2-methylphenoxy)ethyl ester Formula: C17H17NO5 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OCCOC2=CC=CC=C2C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OCCOC2=CC=CC=C2C)[N+](=O)[O-]

InChI

InChI=1S/C17H17NO5/c1-12-7-8-14(11-15(12)18(20)21)17(19)23-10-9-22-16-6-4-3-5-13(16)2/h3-8,11H,9-10H2,1-2H3