(3S)-1-[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3S)-1-[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3S)-1-[2-(3-iodoanilino)-2-oxo-ethyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3S)-1-[2-(3-iodoanilino)-2-oxoethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3S)-1-[2-(3-iodoanilino)-2-oxoethyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3S)-1-[2-(3-iodoanilino)-2-keto-ethyl]-N-phenyl-nipecotamide Formula: C20H22IN3O2 MolecularWeight: 463.31205

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC(=O)NC2=CC(=CC=C2)I)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](CN(C1)CC(=O)NC2=CC(=CC=C2)I)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H22IN3O2/c21-16-7-4-10-18(12-16)22-19(25)14-24-11-5-6-15(13-24)20(26)23-17-8-2-1-3-9-17/h1-4,7-10,12,15H,5-6,11,13-14H2,(H,22,25)(H,23,26)/t15-/m0/s1