[3-[(2R)-1-(cyclohexylcarbonylamino)propan-2-yl]oxyphenyl]methyl-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [3-[(2R)-1-(cyclohexylcarbonylamino)propan-2-yl]oxyphenyl]methyl-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [3-[(1R)-2-(cyclohexanecarbonylamino)-1-methyl-ethoxy]phenyl]methyl-methyl-(3-thienylmethyl)ammonium CAS Name: [3-[(2R)-1-[[cyclohexyl(oxo)methyl]amino]propan-2-yl]oxyphenyl]methyl-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [3-[(2R)-1-(cyclohexanecarbonylamino)propan-2-yl]oxyphenyl]methyl-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [3-[(1R)-2-(cyclohexanecarbonylamino)-1-methyl-ethoxy]benzyl]-methyl-(3-thenyl)ammonium Formula: C23H33N2O2S+ MolecularWeight: 401.58532

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1CCCCC1)OC2=CC=CC(=C2)C[NH+](C)CC3=CSC=C3

Isomeric SMILES

C[C@H](CNC(=O)C1CCCCC1)OC2=CC=CC(=C2)C[NH+](C)CC3=CSC=C3

InChI

InChI=1S/C23H32N2O2S/c1-18(14-24-23(26)21-8-4-3-5-9-21)27-22-10-6-7-19(13-22)15-25(2)16-20-11-12-28-17-20/h6-7,10-13,17-18,21H,3-5,8-9,14-16H2,1-2H3,(H,24,26)/p+1/t18-/m1/s1