[3-chloranyl-2-methyl-3-[4-(pyridin-3-ylmethyl)phenyl]propyl] ethanoate

Systemtic Name: [3-chloranyl-2-methyl-3-[4-(pyridin-3-ylmethyl)phenyl]propyl] ethanoate Openeye Name: [3-chloro-2-methyl-3-[4-(3-pyridylmethyl)phenyl]propyl] acetate CAS Name: acetic acid [3-chloro-2-methyl-3-[4-(3-pyridinylmethyl)phenyl]propyl] ester IUPAC Name: [3-chloro-2-methyl-3-[4-(pyridin-3-ylmethyl)phenyl]propyl] acetate Traditional Name: acetic acid [3-chloro-2-methyl-3-[4-(3-pyridylmethyl)phenyl]propyl] ester Formula: C18H20ClNO2 MolecularWeight: 317.8099

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C)C(C1=CC=C(C=C1)CC2=CN=CC=C2)Cl

Isomeric SMILES

CC(COC(=O)C)C(C1=CC=C(C=C1)CC2=CN=CC=C2)Cl

InChI

InChI=1S/C18H20ClNO2/c1-13(12-22-14(2)21)18(19)17-7-5-15(6-8-17)10-16-4-3-9-20-11-16/h3-9,11,13,18H,10,12H2,1-2H3