2-[3-(1H-indol-3-yl)propanoylamino]-3-oxidanyl-butanoic acid

Systemtic Name: 2-[3-(1H-indol-3-yl)propanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 3-hydroxy-2-[3-(1H-indol-3-yl)propanoylamino]butanoic acid CAS Name: 3-hydroxy-2-[[3-(1H-indol-3-yl)-1-oxopropyl]amino]butanoic acid IUPAC Name: 3-hydroxy-2-[3-(1H-indol-3-yl)propanoylamino]butanoic acid Traditional Name: 3-hydroxy-2-[3-(1H-indol-3-yl)propanoylamino]butyric acid Formula: C15H18N2O4 MolecularWeight: 290.31442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C(=O)O)NC(=O)CCC1=CNC2=CC=CC=C21)O

Isomeric SMILES

CC(C(C(=O)O)NC(=O)CCC1=CNC2=CC=CC=C21)O

InChI

InChI=1S/C15H18N2O4/c1-9(18)14(15(20)21)17-13(19)7-6-10-8-16-12-5-3-2-4-11(10)12/h2-5,8-9,14,16,18H,6-7H2,1H3,(H,17,19)(H,20,21)