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

Systemtic Name: [3-[(2R)-1-(cyclohexylcarbonylamino)propan-2-yl]oxyphenyl]methyl-methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [3-[(1R)-2-(cyclohexanecarbonylamino)-1-methyl-ethoxy]phenyl]methyl-methyl-(2-thienylmethyl)ammonium CAS Name: [3-[(2R)-1-[[cyclohexyl(oxo)methyl]amino]propan-2-yl]oxyphenyl]methyl-methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [3-[(2R)-1-(cyclohexanecarbonylamino)propan-2-yl]oxyphenyl]methyl-methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [3-[(1R)-2-(cyclohexanecarbonylamino)-1-methyl-ethoxy]benzyl]-methyl-(2-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=CC=CS3

Isomeric SMILES

C[C@H](CNC(=O)C1CCCCC1)OC2=CC=CC(=C2)C[NH+](C)CC3=CC=CS3

InChI

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