1-[(3-cyclopentyl-1-methyl-2-pyridin-2-yl-indol-6-yl)carbonylamino]cyclobutane-1-carboxylic acid

Systemtic Name: 1-[(3-cyclopentyl-1-methyl-2-pyridin-2-yl-indol-6-yl)carbonylamino]cyclobutane-1-carboxylic acid Openeye Name: 1-[[3-cyclopentyl-1-methyl-2-(2-pyridyl)indole-6-carbonyl]amino]cyclobutanecarboxylic acid CAS Name: 1-[[[3-cyclopentyl-1-methyl-2-(2-pyridinyl)-6-indolyl]-oxomethyl]amino]-1-cyclobutanecarboxylic acid IUPAC Name: 1-[(3-cyclopentyl-1-methyl-2-pyridin-2-ylindole-6-carbonyl)amino]cyclobutane-1-carboxylic acid Traditional Name: 1-[[3-cyclopentyl-1-methyl-2-(2-pyridyl)indole-6-carbonyl]amino]cyclobutanecarboxylic acid Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C(=O)NC3(CCC3)C(=O)O)C(=C1C4=CC=CC=N4)C5CCCC5

Isomeric SMILES

CN1C2=C(C=CC(=C2)C(=O)NC3(CCC3)C(=O)O)C(=C1C4=CC=CC=N4)C5CCCC5

InChI

InChI=1S/C25H27N3O3/c1-28-20-15-17(23(29)27-25(24(30)31)12-6-13-25)10-11-18(20)21(16-7-2-3-8-16)22(28)19-9-4-5-14-26-19/h4-5,9-11,14-16H,2-3,6-8,12-13H2,1H3,(H,27,29)(H,30,31)