2-chloranyl-5-[(2S)-5-ethyl-1,2-dimethyl-4-pyridin-3-yl-2,3-dihydropyrrol-1-ium-4-yl]pyridine

Systemtic Name: 2-chloranyl-5-[(2S)-5-ethyl-1,2-dimethyl-4-pyridin-3-yl-2,3-dihydropyrrol-1-ium-4-yl]pyridine Openeye Name: 2-chloro-5-[(2S)-5-ethyl-1,2-dimethyl-4-(3-pyridyl)-2,3-dihydropyrrol-1-ium-4-yl]pyridine CAS Name: 2-chloro-5-[(2S)-5-ethyl-1,2-dimethyl-4-(3-pyridinyl)-2,3-dihydropyrrol-1-ium-4-yl]pyridine IUPAC Name: 2-chloro-5-[(2S)-5-ethyl-1,2-dimethyl-4-pyridin-3-yl-2,3-dihydropyrrol-1-ium-4-yl]pyridine Traditional Name: 2-chloro-5-[(5S)-2-ethyl-1,5-dimethyl-3-(3-pyridyl)-1-pyrrolin-1-ium-3-yl]pyridine Formula: C18H21ClN3+ MolecularWeight: 314.83244

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=[N+](C(CC1(C2=CN=CC=C2)C3=CN=C(C=C3)Cl)C)C

Isomeric SMILES

CCC1=[N+]([C@H](CC1(C2=CN=CC=C2)C3=CN=C(C=C3)Cl)C)C

InChI

InChI=1S/C18H21ClN3/c1-4-16-18(10-13(2)22(16)3,14-6-5-9-20-11-14)15-7-8-17(19)21-12-15/h5-9,11-13H,4,10H2,1-3H3/q+1/t13-,18?/m0/s1