cyclopropyl-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-[(2R)-2-oxidanyl-3-phenylmethoxy-propyl]azanium

Systemtic Name: cyclopropyl-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]-[(2R)-2-oxidanyl-3-phenylmethoxy-propyl]azanium Openeye Name: [(2R)-3-benzyloxy-2-hydroxy-propyl]-cyclopropyl-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]ammonium CAS Name: cyclopropyl-[(2R)-2-hydroxy-3-phenylmethoxypropyl]-[[1-[(3-methoxyphenyl)methyl]-2-pyrrolyl]methyl]ammonium IUPAC Name: cyclopropyl-[(2R)-2-hydroxy-3-phenylmethoxypropyl]-[[1-[(3-methoxyphenyl)methyl]pyrrol-2-yl]methyl]azanium Traditional Name: [(2R)-3-benzoxy-2-hydroxy-propyl]-cyclopropyl-[(1-m-anisylpyrrol-2-yl)methyl]ammonium Formula: C26H33N2O3+ MolecularWeight: 421.55182

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C=CC=C2C[NH+](CC(COCC3=CC=CC=C3)O)C4CC4

Isomeric SMILES

COC1=CC=CC(=C1)CN2C=CC=C2C[NH+](C[C@H](COCC3=CC=CC=C3)O)C4CC4

InChI

InChI=1S/C26H32N2O3/c1-30-26-11-5-9-22(15-26)16-27-14-6-10-24(27)17-28(23-12-13-23)18-25(29)20-31-19-21-7-3-2-4-8-21/h2-11,14-15,23,25,29H,12-13,16-20H2,1H3/p+1/t25-/m1/s1