(2S)-2-(cyclobutylcarbonylamino)-3-(1H-indol-3-yl)propanoic acid

Systemtic Name: (2S)-2-(cyclobutylcarbonylamino)-3-(1H-indol-3-yl)propanoic acid Openeye Name: (2S)-2-(cyclobutanecarbonylamino)-3-(1H-indol-3-yl)propanoic acid CAS Name: (2S)-2-[[cyclobutyl(oxo)methyl]amino]-3-(1H-indol-3-yl)propanoic acid IUPAC Name: (2S)-2-(cyclobutanecarbonylamino)-3-(1H-indol-3-yl)propanoic acid Traditional Name: (2S)-2-(cyclobutanecarbonylamino)-3-(1H-indol-3-yl)propionic acid Formula: C16H18N2O3 MolecularWeight: 286.32572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

C1CC(C1)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C16H18N2O3/c19-15(10-4-3-5-10)18-14(16(20)21)8-11-9-17-13-7-2-1-6-12(11)13/h1-2,6-7,9-10,14,17H,3-5,8H2,(H,18,19)(H,20,21)/t14-/m0/s1