[3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[(2R)-2-oxidanylpropyl]azanium

Systemtic Name: [3-chloranyl-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[(2R)-2-oxidanylpropyl]azanium Openeye Name: [3-chloro-5-methoxy-4-(2-thienylmethoxy)phenyl]methyl-[(2R)-2-hydroxypropyl]ammonium CAS Name: [3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[(2R)-2-hydroxypropyl]ammonium IUPAC Name: [3-chloro-5-methoxy-4-(thiophen-2-ylmethoxy)phenyl]methyl-[(2R)-2-hydroxypropyl]azanium Traditional Name: [3-chloro-5-methoxy-4-(2-thenyloxy)benzyl]-[(2R)-2-hydroxypropyl]ammonium Formula: C16H21ClNO3S+ MolecularWeight: 342.86084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C[NH2+]CC1=CC(=C(C(=C1)Cl)OCC2=CC=CS2)OC)O

Isomeric SMILES

C[C@H](C[NH2+]CC1=CC(=C(C(=C1)Cl)OCC2=CC=CS2)OC)O

InChI

InChI=1S/C16H20ClNO3S/c1-11(19)8-18-9-12-6-14(17)16(15(7-12)20-2)21-10-13-4-3-5-22-13/h3-7,11,18-19H,8-10H2,1-2H3/p+1/t11-/m1/s1