ethyl 4-[4-(4-pentan-2-ylphenoxy)butyl]piperazine-1-carboxylate chloride

Systemtic Name: ethyl 4-[4-(4-pentan-2-ylphenoxy)butyl]piperazine-1-carboxylate chloride Openeye Name: ethyl 4-[4-[4-(1-methylbutyl)phenoxy]butyl]piperazine-1-carboxylate chloride CAS Name: 4-[4-(4-pentan-2-ylphenoxy)butyl]-1-piperazinecarboxylic acid ethyl ester chloride IUPAC Name: ethyl 4-[4-(4-pentan-2-ylphenoxy)butyl]piperazine-1-carboxylate chloride Traditional Name: 4-[4-[4-(1-methylbutyl)phenoxy]butyl]piperazine-1-carboxylic acid ethyl ester chloride Formula: C22H36ClN2O3- MolecularWeight: 411.98584

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)C1=CC=C(C=C1)OCCCCN2CCN(CC2)C(=O)OCC.[Cl-]

Isomeric SMILES

CCCC(C)C1=CC=C(C=C1)OCCCCN2CCN(CC2)C(=O)OCC.[Cl-]

InChI

InChI=1S/C22H36N2O3.ClH/c1-4-8-19(3)20-9-11-21(12-10-20)27-18-7-6-13-23-14-16-24(17-15-23)22(25)26-5-2;/h9-12,19H,4-8,13-18H2,1-3H3;1H/p-1