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

Systemtic Name: (3S,4S)-1-[(4-ethylphenyl)methyl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol Openeye Name: (3S,4S)-1-[(4-ethylphenyl)methyl]-4-morpholino-pyrrolidin-1-ium-3-ol CAS Name: (3S,4S)-1-[(4-ethylphenyl)methyl]-4-(4-morpholinyl)-3-pyrrolidin-1-iumol IUPAC Name: (3S,4S)-1-[(4-ethylphenyl)methyl]-4-morpholin-4-ylpyrrolidin-1-ium-3-ol Traditional Name: (3S,4S)-1-(4-ethylbenzyl)-4-morpholino-pyrrolidin-1-ium-3-ol Formula: C17H27N2O2+ MolecularWeight: 291.40848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+]2CC(C(C2)O)N3CCOCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+]2C[C@@H]([C@H](C2)O)N3CCOCC3

InChI

InChI=1S/C17H26N2O2/c1-2-14-3-5-15(6-4-14)11-18-12-16(17(20)13-18)19-7-9-21-10-8-19/h3-6,16-17,20H,2,7-13H2,1H3/p+1/t16-,17-/m0/s1