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

Systemtic Name: 1-[3-oxidanylidene-3-[[(1S)-1-phenylethyl]amino]propyl]-N-(phenylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-benzyl-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]-N-(phenylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-benzyl-1-[3-oxo-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide Traditional Name: N-benzyl-1-[3-keto-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide Formula: C24H32N3O2+ MolecularWeight: 394.52978

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CC[NH+]2CCC(CC2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)CC[NH+]2CCC(CC2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O2/c1-19(21-10-6-3-7-11-21)26-23(28)14-17-27-15-12-22(13-16-27)24(29)25-18-20-8-4-2-5-9-20/h2-11,19,22H,12-18H2,1H3,(H,25,29)(H,26,28)/p+1/t19-/m0/s1