4-[4-[(3-chloranyl-5-methoxy-phenoxy)methyl]-2-(2-naphthalen-1-ylpropanoylamino)phenyl]butanoic acid

Systemtic Name: 4-[4-[(3-chloranyl-5-methoxy-phenoxy)methyl]-2-(2-naphthalen-1-ylpropanoylamino)phenyl]butanoic acid Openeye Name: 4-[4-[(3-chloro-5-methoxy-phenoxy)methyl]-2-[2-(1-naphthyl)propanoylamino]phenyl]butanoic acid CAS Name: 4-[4-[(3-chloro-5-methoxyphenoxy)methyl]-2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]phenyl]butanoic acid IUPAC Name: 4-[4-[(3-chloro-5-methoxyphenoxy)methyl]-2-(2-naphthalen-1-ylpropanoylamino)phenyl]butanoic acid Traditional Name: 4-[4-[(3-chloro-5-methoxy-phenoxy)methyl]-2-[2-(1-naphthyl)propanoylamino]phenyl]butyric acid Formula: C31H30ClNO5 MolecularWeight: 532.0266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)COC4=CC(=CC(=C4)OC)Cl)CCCC(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC(=C3)COC4=CC(=CC(=C4)OC)Cl)CCCC(=O)O

InChI

InChI=1S/C31H30ClNO5/c1-20(27-11-5-8-22-7-3-4-10-28(22)27)31(36)33-29-15-21(13-14-23(29)9-6-12-30(34)35)19-38-26-17-24(32)16-25(18-26)37-2/h3-5,7-8,10-11,13-18,20H,6,9,12,19H2,1-2H3,(H,33,36)(H,34,35)