ST029036

4-[(6-propan-2-yloxycarbonylcyclohex-3-ene-1-carbonyl)amino]benzoic acid

Also Known As: Benzoic acid, 4-[(6-isopropoxycarbonyl-3-cyclohexenyl)carbonylamino]-|4-[(6-propan-2-yloxycarbonylcyclohex-3-ene-1-carbonyl)amino]benzoic acid|4-({6-[(methylethyl)oxycarbonyl]cyclohex-3-enyl}carbonylamino)benzoic acid|4-(([6-(Isopropoxycarbonyl)-3-cyclohexen-1-yl]carbonyl)amino)benzoic acid #|4-(6-{[(Propan-2-yl)oxy]carbonyl}cyclohex-3-ene-1-carboxamido)benzoic acid

Molecular Formula	C18H21NO5
Molecular Weight	331.14197 g/mol
LogP	2.4
Topological Polar Surface Area	92.7 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	331.14197
Monoisotopic Mass	331.14197
Heavy Atoms	24
Complexity	506.0

Chemical Identifiers

CAS Number	5768-69-4
SMILES	CC(C)OC(=O)C1CC=CCC1C(=O)NC2=CC=C(C=C2)C(=O)O
InChIKey	VMOYXGOCFZCCQF-UHFFFAOYSA-N