3-(1H-indol-3-yl)-2-(naphthalen-2-ylsulfonylamino)propanoic acid

Systemtic Name: 3-(1H-indol-3-yl)-2-(naphthalen-2-ylsulfonylamino)propanoic acid Openeye Name: 3-(1H-indol-3-yl)-2-(2-naphthylsulfonylamino)propanoic acid CAS Name: 3-(1H-indol-3-yl)-2-(2-naphthalenylsulfonylamino)propanoic acid IUPAC Name: 3-(1H-indol-3-yl)-2-(naphthalen-2-ylsulfonylamino)propanoic acid Traditional Name: 3-(1H-indol-3-yl)-2-(2-naphthylsulfonylamino)propionic acid Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)S(=O)(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C21H18N2O4S/c24-21(25)20(12-16-13-22-19-8-4-3-7-18(16)19)23-28(26,27)17-10-9-14-5-1-2-6-15(14)11-17/h1-11,13,20,22-23H,12H2,(H,24,25)