(3S,4S)-1-[(8-chloranylquinolin-2-yl)methyl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol

Systemtic Name: (3S,4S)-1-[(8-chloranylquinolin-2-yl)methyl]-4-morpholin-4-yl-pyrrolidin-1-ium-3-ol Openeye Name: (3S,4S)-1-[(8-chloro-2-quinolyl)methyl]-4-morpholino-pyrrolidin-1-ium-3-ol CAS Name: (3S,4S)-1-[(8-chloro-2-quinolinyl)methyl]-4-(4-morpholinyl)-3-pyrrolidin-1-iumol IUPAC Name: (3S,4S)-1-[(8-chloroquinolin-2-yl)methyl]-4-morpholin-4-ylpyrrolidin-1-ium-3-ol Traditional Name: (3S,4S)-1-[(8-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=CC=C4Cl)C=C3

Isomeric SMILES

C1COCCN1[C@H]2C[NH+](C[C@@H]2O)CC3=NC4=C(C=CC=C4Cl)C=C3

InChI

InChI=1S/C18H22ClN3O2/c19-15-3-1-2-13-4-5-14(20-18(13)15)10-21-11-16(17(23)12-21)22-6-8-24-9-7-22/h1-5,16-17,23H,6-12H2/p+1/t16-,17-/m0/s1