2-acetamido-3-(1H-indol-3-yl)propanoic acid; 2,6-bis(azanyl)hexanoic acid

Systemtic Name: 2-acetamido-3-(1H-indol-3-yl)propanoic acid; 2,6-bis(azanyl)hexanoic acid Openeye Name: 2-acetamido-3-(1H-indol-3-yl)propanoic acid; 2,6-diaminohexanoic acid CAS Name: 2-acetamido-3-(1H-indol-3-yl)propanoic acid; 2,6-diaminohexanoic acid IUPAC Name: 2-acetamido-3-(1H-indol-3-yl)propanoic acid; 2,6-diaminohexanoic acid Traditional Name: 2-acetamido-3-(1H-indol-3-yl)propionic acid; 2,6-diaminohexanoic acid Formula: C19H28N4O5 MolecularWeight: 392.44942

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O.C(CCN)CC(C(=O)O)N

Isomeric SMILES

CC(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)O.C(CCN)CC(C(=O)O)N

InChI

InChI=1S/C13H14N2O3.C6H14N2O2/c1-8(16)15-12(13(17)18)6-9-7-14-11-5-3-2-4-10(9)11;7-4-2-1-3-5(8)6(9)10/h2-5,7,12,14H,6H2,1H3,(H,15,16)(H,17,18);5H,1-4,7-8H2,(H,9,10)