(2S)-3-(1H-indol-3-yl)-2-[2-(6-methoxynaphthalen-2-yl)propanoylamino]propanoic acid

Systemtic Name: (2S)-3-(1H-indol-3-yl)-2-[2-(6-methoxynaphthalen-2-yl)propanoylamino]propanoic acid Openeye Name: (2S)-3-(1H-indol-3-yl)-2-[2-(6-methoxy-2-naphthyl)propanoylamino]propanoic acid CAS Name: (2S)-3-(1H-indol-3-yl)-2-[[2-(6-methoxy-2-naphthalenyl)-1-oxopropyl]amino]propanoic acid IUPAC Name: (2S)-3-(1H-indol-3-yl)-2-[2-(6-methoxynaphthalen-2-yl)propanoylamino]propanoic acid Traditional Name: (2S)-3-(1H-indol-3-yl)-2-[2-(6-methoxy-2-naphthyl)propanoylamino]propionic acid Formula: C25H24N2O4 MolecularWeight: 416.46906

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O

Isomeric SMILES

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)N[C@@H](CC3=CNC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C25H24N2O4/c1-15(16-7-8-18-12-20(31-2)10-9-17(18)11-16)24(28)27-23(25(29)30)13-19-14-26-22-6-4-3-5-21(19)22/h3-12,14-15,23,26H,13H2,1-2H3,(H,27,28)(H,29,30)/t15?,23-/m0/s1