6-(1-tert-butylcyclohexyl)-3-[oxidanyl(pyridin-4-ylmethyl)carbamoyl]hexanoate

Systemtic Name: 6-(1-tert-butylcyclohexyl)-3-[oxidanyl(pyridin-4-ylmethyl)carbamoyl]hexanoate Openeye Name: 6-(1-tert-butylcyclohexyl)-3-[hydroxy(4-pyridylmethyl)carbamoyl]hexanoate CAS Name: 6-(1-tert-butylcyclohexyl)-3-[[hydroxy(pyridin-4-ylmethyl)amino]-oxomethyl]hexanoate IUPAC Name: 6-(1-tert-butylcyclohexyl)-3-[hydroxy(pyridin-4-ylmethyl)carbamoyl]hexanoate Traditional Name: 6-(1-tert-butylcyclohexyl)-3-[hydroxy(4-pyridylmethyl)carbamoyl]hexanoate Formula: C23H35N2O4- MolecularWeight: 403.535

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1(CCCCC1)CCCC(CC(=O)[O-])C(=O)N(CC2=CC=NC=C2)O

Isomeric SMILES

CC(C)(C)C1(CCCCC1)CCCC(CC(=O)[O-])C(=O)N(CC2=CC=NC=C2)O

InChI

InChI=1S/C23H36N2O4/c1-22(2,3)23(11-5-4-6-12-23)13-7-8-19(16-20(26)27)21(28)25(29)17-18-9-14-24-15-10-18/h9-10,14-15,19,29H,4-8,11-13,16-17H2,1-3H3,(H,26,27)/p-1