[2-(cyclopentylamino)-2-oxidanylidene-ethyl] 3,5-ditert-butylbenzoate

Systemtic Name: [2-(cyclopentylamino)-2-oxidanylidene-ethyl] 3,5-ditert-butylbenzoate Openeye Name: [2-(cyclopentylamino)-2-oxo-ethyl] 3,5-ditert-butylbenzoate CAS Name: 3,5-ditert-butylbenzoic acid [2-(cyclopentylamino)-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylamino)-2-oxoethyl] 3,5-ditert-butylbenzoate Traditional Name: 3,5-ditert-butylbenzoic acid [2-(cyclopentylamino)-2-keto-ethyl] ester Formula: C22H33NO3 MolecularWeight: 359.50232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2CCCC2)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C(=O)OCC(=O)NC2CCCC2)C(C)(C)C

InChI

InChI=1S/C22H33NO3/c1-21(2,3)16-11-15(12-17(13-16)22(4,5)6)20(25)26-14-19(24)23-18-9-7-8-10-18/h11-13,18H,7-10,14H2,1-6H3,(H,23,24)