2-[[3-methoxy-2-(2-naphthalen-1-ylpropanoylamino)phenyl]methyl]benzoic acid

Systemtic Name: 2-[[3-methoxy-2-(2-naphthalen-1-ylpropanoylamino)phenyl]methyl]benzoic acid Openeye Name: 2-[[3-methoxy-2-[2-(1-naphthyl)propanoylamino]phenyl]methyl]benzoic acid CAS Name: 2-[[3-methoxy-2-[[2-(1-naphthalenyl)-1-oxopropyl]amino]phenyl]methyl]benzoic acid IUPAC Name: 2-[[3-methoxy-2-(2-naphthalen-1-ylpropanoylamino)phenyl]methyl]benzoic acid Traditional Name: 2-[3-methoxy-2-[2-(1-naphthyl)propanoylamino]benzyl]benzoic acid Formula: C28H25NO4 MolecularWeight: 439.5024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC=C3OC)CC4=CC=CC=C4C(=O)O

Isomeric SMILES

CC(C1=CC=CC2=CC=CC=C21)C(=O)NC3=C(C=CC=C3OC)CC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C28H25NO4/c1-18(22-15-7-11-19-9-3-5-13-23(19)22)27(30)29-26-21(12-8-16-25(26)33-2)17-20-10-4-6-14-24(20)28(31)32/h3-16,18H,17H2,1-2H3,(H,29,30)(H,31,32)