methyl 3-(4-cyanophenyl)-3-[5-(hydroxymethyl)imidazol-1-yl]propanoate

Systemtic Name: methyl 3-(4-cyanophenyl)-3-[5-(hydroxymethyl)imidazol-1-yl]propanoate Openeye Name: methyl 3-(4-cyanophenyl)-3-[5-(hydroxymethyl)imidazol-1-yl]propanoate CAS Name: 3-(4-cyanophenyl)-3-[5-(hydroxymethyl)-1-imidazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-(4-cyanophenyl)-3-[5-(hydroxymethyl)imidazol-1-yl]propanoate Traditional Name: 3-(4-cyanophenyl)-3-(5-methylolimidazol-1-yl)propionic acid methyl ester Formula: C15H15N3O3 MolecularWeight: 285.2979

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=C(C=C1)C#N)N2C=NC=C2CO

Isomeric SMILES

COC(=O)CC(C1=CC=C(C=C1)C#N)N2C=NC=C2CO

InChI

InChI=1S/C15H15N3O3/c1-21-15(20)6-14(18-10-17-8-13(18)9-19)12-4-2-11(7-16)3-5-12/h2-5,8,10,14,19H,6,9H2,1H3