1-[3-oxidanylidene-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[3-oxidanylidene-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[3-oxo-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[3-oxo-3-[[(1S)-1-phenylethyl]amino]propyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[3-oxo-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[3-keto-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide Formula: C17H26N3O2+ MolecularWeight: 304.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CC[NH+]2CCC(CC2)C(=O)N

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)CC[NH+]2CCC(CC2)C(=O)N

InChI

InChI=1S/C17H25N3O2/c1-13(14-5-3-2-4-6-14)19-16(21)9-12-20-10-7-15(8-11-20)17(18)22/h2-6,13,15H,7-12H2,1H3,(H2,18,22)(H,19,21)/p+1/t13-/m0/s1