(2S)-2-azanyl-3-(2-chloranyl-1-methyl-indol-3-yl)propanoic acid

Systemtic Name: (2S)-2-azanyl-3-(2-chloranyl-1-methyl-indol-3-yl)propanoic acid Openeye Name: (2S)-2-amino-3-(2-chloro-1-methyl-indol-3-yl)propanoic acid CAS Name: (2S)-2-amino-3-(2-chloro-1-methyl-3-indolyl)propanoic acid IUPAC Name: (2S)-2-amino-3-(2-chloro-1-methylindol-3-yl)propanoic acid Traditional Name: (2S)-2-amino-3-(2-chloro-1-methyl-indol-3-yl)propionic acid Formula: C12H13ClN2O2 MolecularWeight: 252.69682

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1Cl)CC(C(=O)O)N

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1Cl)C[C@@H](C(=O)O)N

InChI

InChI=1S/C12H13ClN2O2/c1-15-10-5-3-2-4-7(10)8(11(15)13)6-9(14)12(16)17/h2-5,9H,6,14H2,1H3,(H,16,17)/t9-/m0/s1