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

Systemtic Name: 2-azanyl-3-[1-(3-sulfanylpropanoyl)indol-3-yl]propanoic acid Openeye Name: 2-amino-3-[1-(3-sulfanylpropanoyl)indol-3-yl]propanoic acid CAS Name: 2-amino-3-[1-(3-mercapto-1-oxopropyl)-3-indolyl]propanoic acid IUPAC Name: 2-amino-3-[1-(3-sulfanylpropanoyl)indol-3-yl]propanoic acid Traditional Name: 2-amino-3-[1-(3-mercaptopropanoyl)indol-3-yl]propionic acid Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16N2O3S/c15-11(14(18)19)7-9-8-16(13(17)5-6-20)12-4-2-1-3-10(9)12/h1-4,8,11,20H,5-7,15H2,(H,18,19)