(3-chloranyl-5-methoxy-4-oxidanyl-phenyl)methyl-[(1R)-2-methyl-1-thiophen-2-yl-propyl]azanium

Systemtic Name: (3-chloranyl-5-methoxy-4-oxidanyl-phenyl)methyl-[(1R)-2-methyl-1-thiophen-2-yl-propyl]azanium Openeye Name: (3-chloro-4-hydroxy-5-methoxy-phenyl)methyl-[(1R)-2-methyl-1-(2-thienyl)propyl]ammonium CAS Name: (3-chloro-4-hydroxy-5-methoxyphenyl)methyl-[(1R)-2-methyl-1-thiophen-2-ylpropyl]ammonium IUPAC Name: (3-chloro-4-hydroxy-5-methoxyphenyl)methyl-[(1R)-2-methyl-1-thiophen-2-ylpropyl]azanium Traditional Name: (3-chloro-4-hydroxy-5-methoxy-benzyl)-[(1R)-2-methyl-1-(2-thienyl)propyl]ammonium Formula: C16H21ClNO2S+ MolecularWeight: 326.86144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)[NH2+]CC2=CC(=C(C(=C2)Cl)O)OC

Isomeric SMILES

CC(C)[C@H](C1=CC=CS1)[NH2+]CC2=CC(=C(C(=C2)Cl)O)OC

InChI

InChI=1S/C16H20ClNO2S/c1-10(2)15(14-5-4-6-21-14)18-9-11-7-12(17)16(19)13(8-11)20-3/h4-8,10,15,18-19H,9H2,1-3H3/p+1/t15-/m1/s1