2-[[2-azanyl-3-(5-oxidanyl-1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid

Systemtic Name: 2-[[2-azanyl-3-(5-oxidanyl-1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid Openeye Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid CAS Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)-1-oxopropyl]amino]-3-(1H-imidazol-5-yl)propanoic acid IUPAC Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propanoic acid Traditional Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]-3-(1H-imidazol-5-yl)propionic acid Formula: C17H19N5O4 MolecularWeight: 357.36386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)NC(CC3=CN=CN3)C(=O)O)N

Isomeric SMILES

C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)NC(CC3=CN=CN3)C(=O)O)N

InChI

InChI=1S/C17H19N5O4/c18-13(3-9-6-20-14-2-1-11(23)5-12(9)14)16(24)22-15(17(25)26)4-10-7-19-8-21-10/h1-2,5-8,13,15,20,23H,3-4,18H2,(H,19,21)(H,22,24)(H,25,26)