(3S)-1-[2-(cycloheptylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxylate

Systemtic Name: (3S)-1-[2-(cycloheptylamino)-2-oxidanylidene-ethyl]piperidin-1-ium-3-carboxylate Openeye Name: (3S)-1-[2-(cycloheptylamino)-2-oxo-ethyl]piperidin-1-ium-3-carboxylate CAS Name: (3S)-1-[2-(cycloheptylamino)-2-oxoethyl]-3-piperidin-1-iumcarboxylate IUPAC Name: (3S)-1-[2-(cycloheptylamino)-2-oxoethyl]piperidin-1-ium-3-carboxylate Traditional Name: (3S)-1-[2-(cycloheptylamino)-2-keto-ethyl]piperidin-1-ium-3-carboxylate Formula: C15H26N2O3 MolecularWeight: 282.37854

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C[NH+]2CCCC(C2)C(=O)[O-]

Isomeric SMILES

C1CCCC(CC1)NC(=O)C[NH+]2CCC[C@@H](C2)C(=O)[O-]

InChI

InChI=1S/C15H26N2O3/c18-14(16-13-7-3-1-2-4-8-13)11-17-9-5-6-12(10-17)15(19)20/h12-13H,1-11H2,(H,16,18)(H,19,20)/t12-/m0/s1