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

Systemtic Name: 2-[[2-azanyl-3-(5-oxidanyl-1H-indol-3-yl)propanoyl]amino]pentanedioic acid Openeye Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]pentanedioic acid CAS Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)-1-oxopropyl]amino]pentanedioic acid IUPAC Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]pentanedioic acid Traditional Name: 2-[[2-amino-3-(5-hydroxy-1H-indol-3-yl)propanoyl]amino]glutaric acid Formula: C16H19N3O6 MolecularWeight: 349.33856

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)NC(CCC(=O)O)C(=O)O)N

Isomeric SMILES

C1=CC2=C(C=C1O)C(=CN2)CC(C(=O)NC(CCC(=O)O)C(=O)O)N

InChI

InChI=1S/C16H19N3O6/c17-11(15(23)19-13(16(24)25)3-4-14(21)22)5-8-7-18-12-2-1-9(20)6-10(8)12/h1-2,6-7,11,13,18,20H,3-5,17H2,(H,19,23)(H,21,22)(H,24,25)