4-(1H-indol-3-yl)-4-[[oxidanyl-(phenylmethyl)phosphoryl]amino]butanoic acid

Systemtic Name: 4-(1H-indol-3-yl)-4-[[oxidanyl-(phenylmethyl)phosphoryl]amino]butanoic acid Openeye Name: 4-[[benzyl(hydroxy)phosphoryl]amino]-4-(1H-indol-3-yl)butanoic acid CAS Name: 4-[[hydroxy-(phenylmethyl)phosphoryl]amino]-4-(1H-indol-3-yl)butanoic acid IUPAC Name: 4-[[benzyl(hydroxy)phosphoryl]amino]-4-(1H-indol-3-yl)butanoic acid Traditional Name: 4-[[benzyl(hydroxy)phosphoryl]amino]-4-(1H-indol-3-yl)butyric acid Formula: C19H21N2O4P MolecularWeight: 372.354801

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CP(=O)(NC(CCC(=O)O)C2=CNC3=CC=CC=C32)O

Isomeric SMILES

C1=CC=C(C=C1)CP(=O)(NC(CCC(=O)O)C2=CNC3=CC=CC=C32)O

InChI

InChI=1S/C19H21N2O4P/c22-19(23)11-10-18(16-12-20-17-9-5-4-8-15(16)17)21-26(24,25)13-14-6-2-1-3-7-14/h1-9,12,18,20H,10-11,13H2,(H,22,23)(H2,21,24,25)