(2S)-3-(4-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl-naphthalen-2-ylcarbonyl-amino]propanoic acid

Systemtic Name: (2S)-3-(4-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl-naphthalen-2-ylcarbonyl-amino]propanoic acid Openeye Name: (2S)-3-(4-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl-(naphthalene-2-carbonyl)amino]propanoic acid CAS Name: (2S)-3-(4-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl-[2-naphthalenyl(oxo)methyl]amino]propanoic acid IUPAC Name: (2S)-3-(4-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl-(naphthalene-2-carbonyl)amino]propanoic acid Traditional Name: (2S)-3-(4-hydroxyphenyl)-2-[2-(1H-indol-3-yl)ethyl-(2-naphthoyl)amino]propionic acid Formula: C30H26N2O4 MolecularWeight: 478.53844

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C(=O)N(CCC3=CNC4=CC=CC=C43)C(CC5=CC=C(C=C5)O)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C(=O)N(CCC3=CNC4=CC=CC=C43)[C@@H](CC5=CC=C(C=C5)O)C(=O)O

InChI

InChI=1S/C30H26N2O4/c33-25-13-9-20(10-14-25)17-28(30(35)36)32(16-15-24-19-31-27-8-4-3-7-26(24)27)29(34)23-12-11-21-5-1-2-6-22(21)18-23/h1-14,18-19,28,31,33H,15-17H2,(H,35,36)/t28-/m0/s1