phenethyl-(phenylmethyl)-(1-thiophen-2-ylcarbonylpiperidin-4-yl)azanium

Systemtic Name: phenethyl-(phenylmethyl)-(1-thiophen-2-ylcarbonylpiperidin-4-yl)azanium Openeye Name: benzyl-phenethyl-[1-(thiophene-2-carbonyl)-4-piperidyl]ammonium CAS Name: [1-[oxo(thiophen-2-yl)methyl]-4-piperidinyl]-phenethyl-(phenylmethyl)ammonium IUPAC Name: benzyl-phenethyl-[1-(thiophene-2-carbonyl)piperidin-4-yl]azanium Traditional Name: benzyl-phenethyl-[1-(2-thenoyl)-4-piperidyl]ammonium Formula: C25H29N2OS+ MolecularWeight: 405.57556

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+](CCC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCC1[NH+](CCC2=CC=CC=C2)CC3=CC=CC=C3)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H28N2OS/c28-25(24-12-7-19-29-24)26-17-14-23(15-18-26)27(20-22-10-5-2-6-11-22)16-13-21-8-3-1-4-9-21/h1-12,19,23H,13-18,20H2/p+1