methyl-(phenylmethyl)-[2-[(2-thiophen-2-ylethanoylamino)methyl]-1,3-dihydroinden-2-yl]azanium

Systemtic Name: methyl-(phenylmethyl)-[2-[(2-thiophen-2-ylethanoylamino)methyl]-1,3-dihydroinden-2-yl]azanium Openeye Name: benzyl-methyl-[2-[[[2-(2-thienyl)acetyl]amino]methyl]indan-2-yl]ammonium CAS Name: methyl-[2-[[(1-oxo-2-thiophen-2-ylethyl)amino]methyl]-1,3-dihydroinden-2-yl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[2-[[(2-thiophen-2-ylacetyl)amino]methyl]-1,3-dihydroinden-2-yl]azanium Traditional Name: benzyl-methyl-[2-[[[2-(2-thienyl)acetyl]amino]methyl]indan-2-yl]ammonium Formula: C24H27N2OS+ MolecularWeight: 391.54898

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)CNC(=O)CC4=CC=CS4

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)C2(CC3=CC=CC=C3C2)CNC(=O)CC4=CC=CS4

InChI

InChI=1S/C24H26N2OS/c1-26(17-19-8-3-2-4-9-19)24(15-20-10-5-6-11-21(20)16-24)18-25-23(27)14-22-12-7-13-28-22/h2-13H,14-18H2,1H3,(H,25,27)/p+1