2-[[3-(5-chloranyl-6-methoxy-naphthalen-2-yl)-2-methyl-propanoyl]amino]-5-fluoranyl-benzoic acid

Systemtic Name: 2-[[3-(5-chloranyl-6-methoxy-naphthalen-2-yl)-2-methyl-propanoyl]amino]-5-fluoranyl-benzoic acid Openeye Name: 2-[[3-(5-chloro-6-methoxy-2-naphthyl)-2-methyl-propanoyl]amino]-5-fluoro-benzoic acid CAS Name: 2-[[3-(5-chloro-6-methoxy-2-naphthalenyl)-2-methyl-1-oxopropyl]amino]-5-fluorobenzoic acid IUPAC Name: 2-[[3-(5-chloro-6-methoxynaphthalen-2-yl)-2-methylpropanoyl]amino]-5-fluorobenzoic acid Traditional Name: 2-[[3-(5-chloro-6-methoxy-2-naphthyl)-2-methyl-propanoyl]amino]-5-fluoro-benzoic acid Formula: C22H19ClFNO4 MolecularWeight: 415.841963

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC2=C(C=C1)C(=C(C=C2)OC)Cl)C(=O)NC3=C(C=C(C=C3)F)C(=O)O

Isomeric SMILES

CC(CC1=CC2=C(C=C1)C(=C(C=C2)OC)Cl)C(=O)NC3=C(C=C(C=C3)F)C(=O)O

InChI

InChI=1S/C22H19ClFNO4/c1-12(21(26)25-18-7-5-15(24)11-17(18)22(27)28)9-13-3-6-16-14(10-13)4-8-19(29-2)20(16)23/h3-8,10-12H,9H2,1-2H3,(H,25,26)(H,27,28)