N-(2-hydroxyphenyl)-1-[(2R)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-(2-hydroxyphenyl)-1-[(2R)-1-oxidanylidene-1-[(2-phenylphenyl)amino]propan-2-yl]piperidin-1-ium-4-carboxamide Openeye Name: N-(2-hydroxyphenyl)-1-[(1R)-1-methyl-2-oxo-2-(2-phenylanilino)ethyl]piperidin-1-ium-4-carboxamide CAS Name: N-(2-hydroxyphenyl)-1-[(2R)-1-oxo-1-(2-phenylanilino)propan-2-yl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-(2-hydroxyphenyl)-1-[(2R)-1-oxo-1-(2-phenylanilino)propan-2-yl]piperidin-1-ium-4-carboxamide Traditional Name: N-(2-hydroxyphenyl)-1-[(1R)-2-keto-1-methyl-2-(2-phenylanilino)ethyl]piperidin-1-ium-4-carboxamide Formula: C27H30N3O3+ MolecularWeight: 444.5454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)NC4=CC=CC=C4O

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)NC4=CC=CC=C4O

InChI

InChI=1S/C27H29N3O3/c1-19(26(32)28-23-12-6-5-11-22(23)20-9-3-2-4-10-20)30-17-15-21(16-18-30)27(33)29-24-13-7-8-14-25(24)31/h2-14,19,21,31H,15-18H2,1H3,(H,28,32)(H,29,33)/p+1/t19-/m1/s1