[4-(3-methylbutoxy)phenyl]methyl-[(1R)-1-thiophen-2-ylethyl]azanium

Systemtic Name: [4-(3-methylbutoxy)phenyl]methyl-[(1R)-1-thiophen-2-ylethyl]azanium Openeye Name: (4-isopentyloxyphenyl)methyl-[(1R)-1-(2-thienyl)ethyl]ammonium CAS Name: [4-(3-methylbutoxy)phenyl]methyl-[(1R)-1-thiophen-2-ylethyl]ammonium IUPAC Name: [4-(3-methylbutoxy)phenyl]methyl-[(1R)-1-thiophen-2-ylethyl]azanium Traditional Name: (4-isoamoxybenzyl)-[(1R)-1-(2-thienyl)ethyl]ammonium Formula: C18H26NOS+ MolecularWeight: 304.47014

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C[NH2+]C(C)C2=CC=CS2

Isomeric SMILES

C[C@H](C1=CC=CS1)[NH2+]CC2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C18H25NOS/c1-14(2)10-11-20-17-8-6-16(7-9-17)13-19-15(3)18-5-4-12-21-18/h4-9,12,14-15,19H,10-11,13H2,1-3H3/p+1/t15-/m1/s1