2-[2-chloranyl-3-(phenylmethyl)quinolin-6-yl]ethanoate

Systemtic Name: 2-[2-chloranyl-3-(phenylmethyl)quinolin-6-yl]ethanoate Openeye Name: 2-(3-benzyl-2-chloro-6-quinolyl)acetate CAS Name: 2-[2-chloro-3-(phenylmethyl)-6-quinolinyl]acetate IUPAC Name: 2-(3-benzyl-2-chloroquinolin-6-yl)acetate Traditional Name: 2-(3-benzyl-2-chloro-6-quinolyl)acetate Formula: C18H13ClNO2- MolecularWeight: 310.75432

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=C(N=C3C=CC(=CC3=C2)CC(=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CC2=C(N=C3C=CC(=CC3=C2)CC(=O)[O-])Cl

InChI

InChI=1S/C18H14ClNO2/c19-18-15(8-12-4-2-1-3-5-12)11-14-9-13(10-17(21)22)6-7-16(14)20-18/h1-7,9,11H,8,10H2,(H,21,22)/p-1