2-azanyl-3-(6-chloranyl-1H-indol-3-yl)propanoic acid; methanesulfonic acid

Systemtic Name: 2-azanyl-3-(6-chloranyl-1H-indol-3-yl)propanoic acid; methanesulfonic acid Openeye Name: 2-amino-3-(6-chloro-1H-indol-3-yl)propanoic acid; methanesulfonic acid CAS Name: 2-amino-3-(6-chloro-1H-indol-3-yl)propanoic acid; methanesulfonic acid IUPAC Name: 2-amino-3-(6-chloro-1H-indol-3-yl)propanoic acid; methanesulfonic acid Traditional Name: 2-amino-3-(6-chloro-1H-indol-3-yl)propionic acid; mesylic acid Formula: C12H15ClN2O5S MolecularWeight: 334.7759

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)O.C1=CC2=C(C=C1Cl)NC=C2CC(C(=O)O)N

Isomeric SMILES

CS(=O)(=O)O.C1=CC2=C(C=C1Cl)NC=C2CC(C(=O)O)N

InChI

InChI=1S/C11H11ClN2O2.CH4O3S/c12-7-1-2-8-6(3-9(13)11(15)16)5-14-10(8)4-7;1-5(2,3)4/h1-2,4-5,9,14H,3,13H2,(H,15,16);1H3,(H,2,3,4)