2-methoxyethyl-[(2R)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]-[[1-(phenylmethyl)pyrrol-2-yl]methyl]azanium

Systemtic Name: 2-methoxyethyl-[(2R)-3-morpholin-4-ium-4-yl-2-oxidanyl-propyl]-[[1-(phenylmethyl)pyrrol-2-yl]methyl]azanium Openeye Name: (1-benzylpyrrol-2-yl)methyl-[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]-(2-methoxyethyl)ammonium CAS Name: [(2R)-2-hydroxy-3-(4-morpholin-4-iumyl)propyl]-(2-methoxyethyl)-[[1-(phenylmethyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: (1-benzylpyrrol-2-yl)methyl-[(2R)-2-hydroxy-3-morpholin-4-ium-4-ylpropyl]-(2-methoxyethyl)azanium Traditional Name: (1-benzylpyrrol-2-yl)methyl-[(2R)-2-hydroxy-3-morpholin-4-ium-4-yl-propyl]-(2-methoxyethyl)ammonium Formula: C22H35N3O3+2 MolecularWeight: 389.5316

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Descriptors Computed from Structure

Canonical SMILES:

COCC[NH+](CC1=CC=CN1CC2=CC=CC=C2)CC(C[NH+]3CCOCC3)O

Isomeric SMILES

COCC[NH+](CC1=CC=CN1CC2=CC=CC=C2)C[C@H](C[NH+]3CCOCC3)O

InChI

InChI=1S/C22H33N3O3/c1-27-13-10-24(19-22(26)18-23-11-14-28-15-12-23)17-21-8-5-9-25(21)16-20-6-3-2-4-7-20/h2-9,22,26H,10-19H2,1H3/p+2/t22-/m0/s1