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

Systemtic Name: 1-[3-oxidanylidene-3-[[(1S)-1-phenylethyl]amino]propyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[3-oxo-3-[[(1S)-1-phenylethyl]amino]propyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[3-oxo-3-[[(1S)-1-phenylethyl]amino]propyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[3-oxo-3-[[(1S)-1-phenylethyl]amino]propyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[3-keto-3-[[(1S)-1-phenylethyl]amino]propyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C23H30N3O2+ MolecularWeight: 380.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)CC[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)CC[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O2/c1-18(19-8-4-2-5-9-19)24-22(27)14-17-26-15-12-20(13-16-26)23(28)25-21-10-6-3-7-11-21/h2-11,18,20H,12-17H2,1H3,(H,24,27)(H,25,28)/p+1/t18-/m0/s1