2-azanyl-3-[1-(2-chloranylethanoyl)indol-3-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[1-(2-chloranylethanoyl)indol-3-yl]propanoic acid Openeye Name: 2-amino-3-[1-(2-chloroacetyl)indol-3-yl]propanoic acid CAS Name: 2-amino-3-[1-(2-chloro-1-oxoethyl)-3-indolyl]propanoic acid IUPAC Name: 2-amino-3-[1-(2-chloroacetyl)indol-3-yl]propanoic acid Traditional Name: 2-amino-3-[1-(2-chloroacetyl)indol-3-yl]propionic acid Formula: C13H13ClN2O3 MolecularWeight: 280.70692

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2C(=O)CCl)CC(C(=O)O)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2C(=O)CCl)CC(C(=O)O)N

InChI

InChI=1S/C13H13ClN2O3/c14-6-12(17)16-7-8(5-10(15)13(18)19)9-3-1-2-4-11(9)16/h1-4,7,10H,5-6,15H2,(H,18,19)