(3-ethoxy-5-iodanyl-4-propan-2-yloxy-phenyl)methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: (3-ethoxy-5-iodanyl-4-propan-2-yloxy-phenyl)methyl-[(1R)-1-phenylethyl]azanium Openeye Name: (3-ethoxy-5-iodo-4-isopropoxy-phenyl)methyl-[(1R)-1-phenylethyl]ammonium CAS Name: (3-ethoxy-5-iodo-4-propan-2-yloxyphenyl)methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: (3-ethoxy-5-iodo-4-propan-2-yloxyphenyl)methyl-[(1R)-1-phenylethyl]azanium Traditional Name: (3-ethoxy-5-iodo-4-isopropoxy-benzyl)-[(1R)-1-phenylethyl]ammonium Formula: C20H27INO2+ MolecularWeight: 440.33835

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C[NH2+][C@H](C)C2=CC=CC=C2)I)OC(C)C

InChI

InChI=1S/C20H26INO2/c1-5-23-19-12-16(11-18(21)20(19)24-14(2)3)13-22-15(4)17-9-7-6-8-10-17/h6-12,14-15,22H,5,13H2,1-4H3/p+1/t15-/m1/s1