(4-imidazol-1-ylphenyl) 3-methylbenzoate

Systemtic Name: (4-imidazol-1-ylphenyl) 3-methylbenzoate Openeye Name: (4-imidazol-1-ylphenyl) 3-methylbenzoate CAS Name: 3-methylbenzoic acid [4-(1-imidazolyl)phenyl] ester IUPAC Name: (4-imidazol-1-ylphenyl) 3-methylbenzoate Traditional Name: 3-methylbenzoic acid (4-imidazol-1-ylphenyl) ester Formula: C17H14N2O2 MolecularWeight: 278.30526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)N3C=CN=C3

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)N3C=CN=C3

InChI

InChI=1S/C17H14N2O2/c1-13-3-2-4-14(11-13)17(20)21-16-7-5-15(6-8-16)19-10-9-18-12-19/h2-12H,1H3