(3-chloranyl-4-ethoxy-5-methoxy-phenyl)methyl-[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]azanium

Systemtic Name: (3-chloranyl-4-ethoxy-5-methoxy-phenyl)methyl-[(1S,2R)-1-oxidanyl-1-phenyl-propan-2-yl]azanium Openeye Name: (3-chloro-4-ethoxy-5-methoxy-phenyl)methyl-[(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]ammonium CAS Name: (3-chloro-4-ethoxy-5-methoxyphenyl)methyl-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]ammonium IUPAC Name: (3-chloro-4-ethoxy-5-methoxyphenyl)methyl-[(1S,2R)-1-hydroxy-1-phenylpropan-2-yl]azanium Traditional Name: (3-chloro-4-ethoxy-5-methoxy-benzyl)-[(1R,2S)-2-hydroxy-1-methyl-2-phenyl-ethyl]ammonium Formula: C19H25ClNO3+ MolecularWeight: 350.8597

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Cl)C[NH2+]C(C)C(C2=CC=CC=C2)O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Cl)C[NH2+][C@H](C)[C@H](C2=CC=CC=C2)O)OC

InChI

InChI=1S/C19H24ClNO3/c1-4-24-19-16(20)10-14(11-17(19)23-3)12-21-13(2)18(22)15-8-6-5-7-9-15/h5-11,13,18,21-22H,4,12H2,1-3H3/p+1/t13-,18-/m1/s1