(3S)-1-(4-butylcyclohexyl)carbonylpiperidine-3-carboxylate

Systemtic Name: (3S)-1-(4-butylcyclohexyl)carbonylpiperidine-3-carboxylate Openeye Name: (3S)-1-(4-butylcyclohexanecarbonyl)piperidine-3-carboxylate CAS Name: (3S)-1-[(4-butylcyclohexyl)-oxomethyl]-3-piperidinecarboxylate IUPAC Name: (3S)-1-(4-butylcyclohexanecarbonyl)piperidine-3-carboxylate Traditional Name: (3S)-1-(4-butylcyclohexanecarbonyl)nipecotate Formula: C17H28NO3- MolecularWeight: 294.40912

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CCC(CC1)C(=O)N2CCCC(C2)C(=O)[O-]

Isomeric SMILES

CCCCC1CCC(CC1)C(=O)N2CCC[C@@H](C2)C(=O)[O-]

InChI

InChI=1S/C17H29NO3/c1-2-3-5-13-7-9-14(10-8-13)16(19)18-11-4-6-15(12-18)17(20)21/h13-15H,2-12H2,1H3,(H,20,21)/p-1/t13?,14?,15-/m0/s1