2-imidazol-1-ylethyl 4-methylbenzoate

Systemtic Name: 2-imidazol-1-ylethyl 4-methylbenzoate Openeye Name: 2-imidazol-1-ylethyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid 2-(1-imidazolyl)ethyl ester IUPAC Name: 2-imidazol-1-ylethyl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid 2-imidazol-1-ylethyl ester Formula: C13H14N2O2 MolecularWeight: 230.26246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCCN2C=CN=C2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCCN2C=CN=C2

InChI

InChI=1S/C13H14N2O2/c1-11-2-4-12(5-3-11)13(16)17-9-8-15-7-6-14-10-15/h2-7,10H,8-9H2,1H3