2-azanyl-3-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]butanoic acid

Systemtic Name: 2-azanyl-3-[[3-(1H-indol-3-yl)-1-oxidanyl-1-oxidanylidene-propan-2-yl]amino]butanoic acid Openeye Name: 2-amino-3-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-oxo-ethyl]amino]butanoic acid CAS Name: 2-amino-3-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]butanoic acid IUPAC Name: 2-amino-3-[[1-hydroxy-3-(1H-indol-3-yl)-1-oxopropan-2-yl]amino]butanoic acid Traditional Name: 2-amino-3-[[2-hydroxy-1-(1H-indol-3-ylmethyl)-2-keto-ethyl]amino]butyric acid Formula: C15H19N3O4 MolecularWeight: 305.32906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O4/c1-8(13(16)15(21)22)18-12(14(19)20)6-9-7-17-11-5-3-2-4-10(9)11/h2-5,7-8,12-13,17-18H,6,16H2,1H3,(H,19,20)(H,21,22)