1-[(3,4-dichlorophenyl)methyl]-5-pyrrolidin-1-yl-indole-2-carboxylic acid

Systemtic Name: 1-[(3,4-dichlorophenyl)methyl]-5-pyrrolidin-1-yl-indole-2-carboxylic acid Openeye Name: 1-[(3,4-dichlorophenyl)methyl]-5-pyrrolidin-1-yl-indole-2-carboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)methyl]-5-(1-pyrrolidinyl)-2-indolecarboxylic acid IUPAC Name: 1-[(3,4-dichlorophenyl)methyl]-5-pyrrolidin-1-ylindole-2-carboxylic acid Traditional Name: 1-(3,4-dichlorobenzyl)-5-pyrrolidino-indole-2-carboxylic acid Formula: C20H18Cl2N2O2 MolecularWeight: 389.27512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC3=C(C=C2)N(C(=C3)C(=O)O)CC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1CCN(C1)C2=CC3=C(C=C2)N(C(=C3)C(=O)O)CC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H18Cl2N2O2/c21-16-5-3-13(9-17(16)22)12-24-18-6-4-15(23-7-1-2-8-23)10-14(18)11-19(24)20(25)26/h3-6,9-11H,1-2,7-8,12H2,(H,25,26)