3-[4-(5-carboxyoxy-2-piperidin-4-yl-indol-1-yl)butyl]-1H-indole-5-carboxylic acid

Systemtic Name: 3-[4-(5-carboxyoxy-2-piperidin-4-yl-indol-1-yl)butyl]-1H-indole-5-carboxylic acid Openeye Name: 3-[4-[5-carboxyoxy-2-(4-piperidyl)indol-1-yl]butyl]-1H-indole-5-carboxylic acid CAS Name: 3-[4-[5-carboxyoxy-2-(4-piperidinyl)-1-indolyl]butyl]-1H-indole-5-carboxylic acid IUPAC Name: 3-[4-(5-carboxyoxy-2-piperidin-4-ylindol-1-yl)butyl]-1H-indole-5-carboxylic acid Traditional Name: 3-[4-[5-carboxyoxy-2-(4-piperidyl)indol-1-yl]butyl]-1H-indole-5-carboxylic acid Formula: C27H29N3O5 MolecularWeight: 475.53626

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C2=CC3=C(N2CCCCC4=CNC5=C4C=C(C=C5)C(=O)O)C=CC(=C3)OC(=O)O

Isomeric SMILES

C1CNCCC1C2=CC3=C(N2CCCCC4=CNC5=C4C=C(C=C5)C(=O)O)C=CC(=C3)OC(=O)O

InChI

InChI=1S/C27H29N3O5/c31-26(32)18-4-6-23-22(14-18)19(16-29-23)3-1-2-12-30-24-7-5-21(35-27(33)34)13-20(24)15-25(30)17-8-10-28-11-9-17/h4-7,13-17,28-29H,1-3,8-12H2,(H,31,32)(H,33,34)