N-(2-hydroxyphenyl)-1-[2-oxidanylidene-2-[[(1S)-1-phenylethyl]amino]ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-hydroxyphenyl)-1-[2-oxidanylidene-2-[[(1S)-1-phenylethyl]amino]ethyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(2-hydroxyphenyl)-1-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]piperidin-1-ium-4-carboxamide CAS Name: N-(2-hydroxyphenyl)-1-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(2-hydroxyphenyl)-1-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(2-hydroxyphenyl)-1-[2-keto-2-[[(1S)-1-phenylethyl]amino]ethyl]piperidin-1-ium-4-carboxamide Formula: C22H28N3O3+ MolecularWeight: 382.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)C[NH+]2CCC(CC2)C(=O)NC3=CC=CC=C3O

InChI

InChI=1S/C22H27N3O3/c1-16(17-7-3-2-4-8-17)23-21(27)15-25-13-11-18(12-14-25)22(28)24-19-9-5-6-10-20(19)26/h2-10,16,18,26H,11-15H2,1H3,(H,23,27)(H,24,28)/p+1/t16-/m0/s1