(3S,4S)-1-[[4-methoxy-3-(methoxymethyl)phenyl]methyl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol

Systemtic Name: (3S,4S)-1-[[4-methoxy-3-(methoxymethyl)phenyl]methyl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol Openeye Name: (3S,4S)-1-[[4-methoxy-3-(methoxymethyl)phenyl]methyl]-4-morpholino-pyrrolidin-1-ium-3-ol CAS Name: (3S,4S)-1-[[4-methoxy-3-(methoxymethyl)phenyl]methyl]-4-(4-morpholinyl)-3-pyrrolidin-1-iumol IUPAC Name: (3S,4S)-1-[[4-methoxy-3-(methoxymethyl)phenyl]methyl]-4-morpholin-4-ylpyrrolidin-1-ium-3-ol Traditional Name: (3S,4S)-1-[4-methoxy-3-(methoxymethyl)benzyl]-4-morpholino-pyrrolidin-1-ium-3-ol Formula: C18H29N2O4+ MolecularWeight: 337.43386

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(C=CC(=C1)C[NH+]2CC(C(C2)O)N3CCOCC3)OC

Isomeric SMILES

COCC1=C(C=CC(=C1)C[NH+]2C[C@@H]([C@H](C2)O)N3CCOCC3)OC

InChI

InChI=1S/C18H28N2O4/c1-22-13-15-9-14(3-4-18(15)23-2)10-19-11-16(17(21)12-19)20-5-7-24-8-6-20/h3-4,9,16-17,21H,5-8,10-13H2,1-2H3/p+1/t16-,17-/m0/s1