2-[1-(carboxymethyl)-6-chloranyl-indol-3-yl]-2-pyrrolidin-1-yl-ethanoic acid

Systemtic Name: 2-[1-(carboxymethyl)-6-chloranyl-indol-3-yl]-2-pyrrolidin-1-yl-ethanoic acid Openeye Name: 2-[1-(carboxymethyl)-6-chloro-indol-3-yl]-2-pyrrolidin-1-yl-acetic acid CAS Name: 2-[1-(carboxymethyl)-6-chloro-3-indolyl]-2-(1-pyrrolidinyl)acetic acid IUPAC Name: 2-[1-(carboxymethyl)-6-chloroindol-3-yl]-2-pyrrolidin-1-ylacetic acid Traditional Name: 2-[1-(carboxymethyl)-6-chloro-indol-3-yl]-2-pyrrolidino-acetic acid Formula: C16H17ClN2O4 MolecularWeight: 336.77018

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(C2=CN(C3=C2C=CC(=C3)Cl)CC(=O)O)C(=O)O

Isomeric SMILES

C1CCN(C1)C(C2=CN(C3=C2C=CC(=C3)Cl)CC(=O)O)C(=O)O

InChI

InChI=1S/C16H17ClN2O4/c17-10-3-4-11-12(8-19(9-14(20)21)13(11)7-10)15(16(22)23)18-5-1-2-6-18/h3-4,7-8,15H,1-2,5-6,9H2,(H,20,21)(H,22,23)