1-(carboxymethyl)-3-cyclohexyl-2-(furan-3-yl)indole-6-carboxylic acid

Systemtic Name: 1-(carboxymethyl)-3-cyclohexyl-2-(furan-3-yl)indole-6-carboxylic acid Openeye Name: 1-(carboxymethyl)-3-cyclohexyl-2-(3-furyl)indole-6-carboxylic acid CAS Name: 1-(carboxymethyl)-3-cyclohexyl-2-(3-furanyl)-6-indolecarboxylic acid IUPAC Name: 1-(carboxymethyl)-3-cyclohexyl-2-(furan-3-yl)indole-6-carboxylic acid Traditional Name: 1-(carboxymethyl)-3-cyclohexyl-2-(3-furyl)indole-6-carboxylic acid Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)O)C4=COC=C4

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)O)C4=COC=C4

InChI

InChI=1S/C21H21NO5/c23-18(24)11-22-17-10-14(21(25)26)6-7-16(17)19(13-4-2-1-3-5-13)20(22)15-8-9-27-12-15/h6-10,12-13H,1-5,11H2,(H,23,24)(H,25,26)