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

Systemtic Name: 1-[(1S)-2-[(2-ethoxyphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Openeye Name: 1-[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenyl-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide CAS Name: 1-[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-N-phenyl-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[(1S)-2-(2-ethoxyanilino)-2-oxo-1-phenylethyl]-N-phenylpiperidin-1-ium-4-carboxamide Traditional Name: 1-[(1S)-2-keto-2-(o-phenetidino)-1-phenyl-ethyl]-N-phenyl-piperidin-1-ium-4-carboxamide Formula: C28H32N3O3+ MolecularWeight: 458.57198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C(C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)NC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)[C@H](C2=CC=CC=C2)[NH+]3CCC(CC3)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C28H31N3O3/c1-2-34-25-16-10-9-15-24(25)30-28(33)26(21-11-5-3-6-12-21)31-19-17-22(18-20-31)27(32)29-23-13-7-4-8-14-23/h3-16,22,26H,2,17-20H2,1H3,(H,29,32)(H,30,33)/p+1/t26-/m0/s1