2-(imidazol-1-ylmethyl)-4-(4-methoxyphenyl)-2-methyl-butanoate

Systemtic Name: 2-(imidazol-1-ylmethyl)-4-(4-methoxyphenyl)-2-methyl-butanoate Openeye Name: 2-(imidazol-1-ylmethyl)-4-(4-methoxyphenyl)-2-methyl-butanoate CAS Name: 2-(1-imidazolylmethyl)-4-(4-methoxyphenyl)-2-methylbutanoate IUPAC Name: 2-(imidazol-1-ylmethyl)-4-(4-methoxyphenyl)-2-methylbutanoate Traditional Name: 2-(imidazol-1-ylmethyl)-4-(4-methoxyphenyl)-2-methyl-butyrate Formula: C16H19N2O3- MolecularWeight: 287.33366

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(C=C1)OC)(CN2C=CN=C2)C(=O)[O-]

Isomeric SMILES

CC(CCC1=CC=C(C=C1)OC)(CN2C=CN=C2)C(=O)[O-]

InChI

InChI=1S/C16H20N2O3/c1-16(15(19)20,11-18-10-9-17-12-18)8-7-13-3-5-14(21-2)6-4-13/h3-6,9-10,12H,7-8,11H2,1-2H3,(H,19,20)/p-1