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

Systemtic Name: 3-[4-[5-(piperidin-4-ylcarbamoyl)indol-1-yl]butyl]-1H-indole-5-carboxylic acid Openeye Name: 3-[4-[5-(4-piperidylcarbamoyl)indol-1-yl]butyl]-1H-indole-5-carboxylic acid CAS Name: 3-[4-[5-[oxo-(4-piperidinylamino)methyl]-1-indolyl]butyl]-1H-indole-5-carboxylic acid IUPAC Name: 3-[4-[5-(piperidin-4-ylcarbamoyl)indol-1-yl]butyl]-1H-indole-5-carboxylic acid Traditional Name: 3-[4-[5-(4-piperidylcarbamoyl)indol-1-yl]butyl]-1H-indole-5-carboxylic acid Formula: C27H30N4O3 MolecularWeight: 458.5521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1NC(=O)C2=CC3=C(C=C2)N(C=C3)CCCCC4=CNC5=C4C=C(C=C5)C(=O)O

Isomeric SMILES

C1CNCCC1NC(=O)C2=CC3=C(C=C2)N(C=C3)CCCCC4=CNC5=C4C=C(C=C5)C(=O)O

InChI

InChI=1S/C27H30N4O3/c32-26(30-22-8-11-28-12-9-22)19-5-7-25-18(15-19)10-14-31(25)13-2-1-3-21-17-29-24-6-4-20(27(33)34)16-23(21)24/h4-7,10,14-17,22,28-29H,1-3,8-9,11-13H2,(H,30,32)(H,33,34)