(phenylmethyl) 4-(6-chloranyl-7-ethoxy-7-oxidanylidene-heptyl)piperidine-1-carboxylate

Systemtic Name: (phenylmethyl) 4-(6-chloranyl-7-ethoxy-7-oxidanylidene-heptyl)piperidine-1-carboxylate Openeye Name: benzyl 4-(6-chloro-7-ethoxy-7-oxo-heptyl)piperidine-1-carboxylate CAS Name: 4-(6-chloro-7-ethoxy-7-oxoheptyl)-1-piperidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(6-chloro-7-ethoxy-7-oxoheptyl)piperidine-1-carboxylate Traditional Name: 4-(6-chloro-7-ethoxy-7-keto-heptyl)piperidine-1-carboxylic acid benzyl ester Formula: C22H32ClNO4 MolecularWeight: 409.94678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCCCCC1CCN(CC1)C(=O)OCC2=CC=CC=C2)Cl

Isomeric SMILES

CCOC(=O)C(CCCCCC1CCN(CC1)C(=O)OCC2=CC=CC=C2)Cl

InChI

InChI=1S/C22H32ClNO4/c1-2-27-21(25)20(23)12-8-4-5-9-18-13-15-24(16-14-18)22(26)28-17-19-10-6-3-7-11-19/h3,6-7,10-11,18,20H,2,4-5,8-9,12-17H2,1H3