3-(2-dimethylaminoethyl)-5-phenylmethoxy-indole-1-carboxylic acid

Systemtic Name: 3-(2-dimethylaminoethyl)-5-phenylmethoxy-indole-1-carboxylic acid Openeye Name: 5-benzyloxy-3-(2-dimethylaminoethyl)indole-1-carboxylic acid CAS Name: 3-(2-dimethylaminoethyl)-5-phenylmethoxy-1-indolecarboxylic acid IUPAC Name: 3-(2-dimethylaminoethyl)-5-phenylmethoxyindole-1-carboxylic acid Traditional Name: 5-benzoxy-3-(2-dimethylaminoethyl)indole-1-carboxylic acid Formula: C20H22N2O3 MolecularWeight: 338.40028

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCC1=CN(C2=C1C=C(C=C2)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CN(C)CCC1=CN(C2=C1C=C(C=C2)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C20H22N2O3/c1-21(2)11-10-16-13-22(20(23)24)19-9-8-17(12-18(16)19)25-14-15-6-4-3-5-7-15/h3-9,12-13H,10-11,14H2,1-2H3,(H,23,24)