[4-(2-methoxyethyl)phenyl] 3-methyl-4-nitro-benzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)CCOC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC2=CC=C(C=C2)CCOC)[N+](=O)[O-]

InChI

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