1-[2-(4-carboxypiperidin-1-yl)-2-oxidanylidene-ethyl]-3-cyclohexyl-2-(furan-2-yl)indole-6-carboxylic acid

Systemtic Name: 1-[2-(4-carboxypiperidin-1-yl)-2-oxidanylidene-ethyl]-3-cyclohexyl-2-(furan-2-yl)indole-6-carboxylic acid Openeye Name: 1-[2-(4-carboxy-1-piperidyl)-2-oxo-ethyl]-3-cyclohexyl-2-(2-furyl)indole-6-carboxylic acid CAS Name: 1-[2-(4-carboxy-1-piperidinyl)-2-oxoethyl]-3-cyclohexyl-2-(2-furanyl)-6-indolecarboxylic acid IUPAC Name: 1-[2-(4-carboxypiperidin-1-yl)-2-oxoethyl]-3-cyclohexyl-2-(furan-2-yl)indole-6-carboxylic acid Traditional Name: 1-[2-(4-carboxypiperidino)-2-keto-ethyl]-3-cyclohexyl-2-(2-furyl)indole-6-carboxylic acid Formula: C27H30N2O6 MolecularWeight: 478.5369

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCC(CC4)C(=O)O)C5=CC=CO5

Isomeric SMILES

C1CCC(CC1)C2=C(N(C3=C2C=CC(=C3)C(=O)O)CC(=O)N4CCC(CC4)C(=O)O)C5=CC=CO5

InChI

InChI=1S/C27H30N2O6/c30-23(28-12-10-18(11-13-28)26(31)32)16-29-21-15-19(27(33)34)8-9-20(21)24(17-5-2-1-3-6-17)25(29)22-7-4-14-35-22/h4,7-9,14-15,17-18H,1-3,5-6,10-13,16H2,(H,31,32)(H,33,34)