N-(2-hydroxyphenyl)-1-[3-oxidanylidene-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-hydroxyphenyl)-1-[3-oxidanylidene-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide Openeye Name: N-(2-hydroxyphenyl)-1-[3-oxo-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide CAS Name: N-(2-hydroxyphenyl)-1-[3-oxo-3-[[(1S)-1-phenylethyl]amino]propyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(2-hydroxyphenyl)-1-[3-oxo-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide Traditional Name: N-(2-hydroxyphenyl)-1-[3-keto-3-[[(1S)-1-phenylethyl]amino]propyl]piperidin-1-ium-4-carboxamide Formula: C23H30N3O3+ MolecularWeight: 396.5026

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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=C3O

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O3/c1-17(18-7-3-2-4-8-18)24-22(28)13-16-26-14-11-19(12-15-26)23(29)25-20-9-5-6-10-21(20)27/h2-10,17,19,27H,11-16H2,1H3,(H,24,28)(H,25,29)/p+1/t17-/m0/s1