(3S,4S)-1-[(6-chloranylquinolin-2-yl)methyl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol

Systemtic Name: (3S,4S)-1-[(6-chloranylquinolin-2-yl)methyl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol Openeye Name: (3S,4S)-1-[(6-chloro-2-quinolyl)methyl]-4-morpholino-pyrrolidin-1-ium-3-ol CAS Name: (3S,4S)-1-[(6-chloro-2-quinolinyl)methyl]-4-(4-morpholinyl)-3-pyrrolidin-1-iumol IUPAC Name: (3S,4S)-1-[(6-chloroquinolin-2-yl)methyl]-4-morpholin-4-ylpyrrolidin-1-ium-3-ol Traditional Name: (3S,4S)-1-[(6-chloro-2-quinolyl)methyl]-4-morpholino-pyrrolidin-1-ium-3-ol Formula: C18H23ClN3O2+ MolecularWeight: 348.84712

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2C[NH+](CC2O)CC3=NC4=C(C=C3)C=C(C=C4)Cl

Isomeric SMILES

C1COCCN1[C@H]2C[NH+](C[C@@H]2O)CC3=NC4=C(C=C3)C=C(C=C4)Cl

InChI

InChI=1S/C18H22ClN3O2/c19-14-2-4-16-13(9-14)1-3-15(20-16)10-21-11-17(18(23)12-21)22-5-7-24-8-6-22/h1-4,9,17-18,23H,5-8,10-12H2/p+1/t17-,18-/m0/s1