3-(2-chloranyl-7-methyl-quinolin-3-yl)pentan-3-ylphosphonic acid

Systemtic Name: 3-(2-chloranyl-7-methyl-quinolin-3-yl)pentan-3-ylphosphonic acid Openeye Name: [1-(2-chloro-7-methyl-3-quinolyl)-1-ethyl-propyl]phosphonic acid CAS Name: 3-(2-chloro-7-methyl-3-quinolinyl)pentan-3-ylphosphonic acid IUPAC Name: 3-(2-chloro-7-methylquinolin-3-yl)pentan-3-ylphosphonic acid Traditional Name: [1-(2-chloro-7-methyl-3-quinolyl)-1-ethyl-propyl]phosphonic acid Formula: C15H19ClNO3P MolecularWeight: 327.743021

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1=C(N=C2C=C(C=CC2=C1)C)Cl)P(=O)(O)O

Isomeric SMILES

CCC(CC)(C1=C(N=C2C=C(C=CC2=C1)C)Cl)P(=O)(O)O

InChI

InChI=1S/C15H19ClNO3P/c1-4-15(5-2,21(18,19)20)12-9-11-7-6-10(3)8-13(11)17-14(12)16/h6-9H,4-5H2,1-3H3,(H2,18,19,20)