(2S,4R)-2-azanyl-4-(1H-indol-3-ylmethyl)pentanedioic acid

Systemtic Name: (2S,4R)-2-azanyl-4-(1H-indol-3-ylmethyl)pentanedioic acid Openeye Name: (2S,4R)-2-amino-4-(1H-indol-3-ylmethyl)pentanedioic acid CAS Name: (2S,4R)-2-amino-4-(1H-indol-3-ylmethyl)pentanedioic acid IUPAC Name: (2S,4R)-2-amino-4-(1H-indol-3-ylmethyl)pentanedioic acid Traditional Name: (2S,4R)-2-amino-4-(1H-indol-3-ylmethyl)glutaric acid Formula: C14H16N2O4 MolecularWeight: 276.28784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CC(CC(C(=O)O)N)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C[C@H](C[C@@H](C(=O)O)N)C(=O)O

InChI

InChI=1S/C14H16N2O4/c15-11(14(19)20)6-8(13(17)18)5-9-7-16-12-4-2-1-3-10(9)12/h1-4,7-8,11,16H,5-6,15H2,(H,17,18)(H,19,20)/t8-,11+/m1/s1