2-chloranyl-2-methyl-3-phenoxy-propanoic acid; pyridin-3-ylmethanol

Systemtic Name: 2-chloranyl-2-methyl-3-phenoxy-propanoic acid; pyridin-3-ylmethanol Openeye Name: 2-chloro-2-methyl-3-phenoxy-propanoic acid; 3-pyridylmethanol CAS Name: 2-chloro-2-methyl-3-phenoxypropanoic acid; 3-pyridinylmethanol IUPAC Name: 2-chloro-2-methyl-3-phenoxypropanoic acid; pyridin-3-ylmethanol Traditional Name: 2-chloro-2-methyl-3-phenoxy-propionic acid; 3-pyridylmethanol Formula: C16H18ClNO4 MolecularWeight: 323.77142

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1=CC=CC=C1)(C(=O)O)Cl.C1=CC(=CN=C1)CO

Isomeric SMILES

CC(COC1=CC=CC=C1)(C(=O)O)Cl.C1=CC(=CN=C1)CO

InChI

InChI=1S/C10H11ClO3.C6H7NO/c1-10(11,9(12)13)7-14-8-5-3-2-4-6-8;8-5-6-2-1-3-7-4-6/h2-6H,7H2,1H3,(H,12,13);1-4,8H,5H2