N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide

Systemtic Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1-thiophen-2-ylcarbonyl-piperidine-4-carboxamide Openeye Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide CAS Name: N-[(1R)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-1-[oxo(thiophen-2-yl)methyl]-4-piperidinecarboxamide IUPAC Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide Traditional Name: N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]-1-(2-thenoyl)isonipecotamide Formula: C23H30N3O3S+ MolecularWeight: 428.5676

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC(C[NH+]2CCOCC2)C3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1C(=O)N[C@@H](C[NH+]2CCOCC2)C3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C23H29N3O3S/c27-22(19-8-10-26(11-9-19)23(28)21-7-4-16-30-21)24-20(18-5-2-1-3-6-18)17-25-12-14-29-15-13-25/h1-7,16,19-20H,8-15,17H2,(H,24,27)/p+1/t20-/m0/s1