1-[[(2S)-2-phenylbutanoyl]amino]cyclohexane-1-carboxylate

Systemtic Name: 1-[[(2S)-2-phenylbutanoyl]amino]cyclohexane-1-carboxylate Openeye Name: 1-[[(2S)-2-phenylbutanoyl]amino]cyclohexanecarboxylate CAS Name: 1-[[(2S)-1-oxo-2-phenylbutyl]amino]-1-cyclohexanecarboxylate IUPAC Name: 1-[[(2S)-2-phenylbutanoyl]amino]cyclohexane-1-carboxylate Traditional Name: 1-[[(2S)-2-phenylbutanoyl]amino]cyclohexanecarboxylate Formula: C17H22NO3- MolecularWeight: 288.36148

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2(CCCCC2)C(=O)[O-]

Isomeric SMILES

CC[C@@H](C1=CC=CC=C1)C(=O)NC2(CCCCC2)C(=O)[O-]

InChI

InChI=1S/C17H23NO3/c1-2-14(13-9-5-3-6-10-13)15(19)18-17(16(20)21)11-7-4-8-12-17/h3,5-6,9-10,14H,2,4,7-8,11-12H2,1H3,(H,18,19)(H,20,21)/p-1/t14-/m0/s1