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

Systemtic Name: 3-[4-[4-(5-aminocarbonyl-1H-indol-3-yl)piperidin-1-yl]butyl]-1H-indole-5-carboxylic acid Openeye Name: 3-[4-[4-(5-carbamoyl-1H-indol-3-yl)-1-piperidyl]butyl]-1H-indole-5-carboxylic acid CAS Name: 3-[4-[4-(5-carbamoyl-1H-indol-3-yl)-1-piperidinyl]butyl]-1H-indole-5-carboxylic acid IUPAC Name: 3-[4-[4-(5-carbamoyl-1H-indol-3-yl)piperidin-1-yl]butyl]-1H-indole-5-carboxylic acid Traditional Name: 3-[4-[4-(5-carbamoyl-1H-indol-3-yl)piperidino]butyl]-1H-indole-5-carboxylic acid Formula: C27H30N4O3 MolecularWeight: 458.5521

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=CNC3=C2C=C(C=C3)C(=O)N)CCCCC4=CNC5=C4C=C(C=C5)C(=O)O

Isomeric SMILES

C1CN(CCC1C2=CNC3=C2C=C(C=C3)C(=O)N)CCCCC4=CNC5=C4C=C(C=C5)C(=O)O

InChI

InChI=1S/C27H30N4O3/c28-26(32)18-4-6-25-22(13-18)23(16-30-25)17-8-11-31(12-9-17)10-2-1-3-20-15-29-24-7-5-19(27(33)34)14-21(20)24/h4-7,13-17,29-30H,1-3,8-12H2,(H2,28,32)(H,33,34)