7-[(R)-(2,5-dimethylphenyl)-(pyridin-1-ium-2-ylamino)methyl]-2-methyl-quinolin-8-ol

Systemtic Name: 7-[(R)-(2,5-dimethylphenyl)-(pyridin-1-ium-2-ylamino)methyl]-2-methyl-quinolin-8-ol Openeye Name: 7-[(R)-(2,5-dimethylphenyl)-(pyridin-1-ium-2-ylamino)methyl]-2-methyl-quinolin-8-ol CAS Name: 7-[(R)-(2,5-dimethylphenyl)-(2-pyridin-1-iumylamino)methyl]-2-methyl-8-quinolinol IUPAC Name: 7-[(R)-(2,5-dimethylphenyl)-(pyridin-1-ium-2-ylamino)methyl]-2-methylquinolin-8-ol Traditional Name: 7-[(R)-(2,5-dimethylphenyl)-(pyridin-1-ium-2-ylamino)methyl]-2-methyl-quinolin-8-ol Formula: C24H24N3O+ MolecularWeight: 370.46686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C(C2=C(C3=C(C=CC(=N3)C)C=C2)O)NC4=CC=CC=[NH+]4

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@H](C2=C(C3=C(C=CC(=N3)C)C=C2)O)NC4=CC=CC=[NH+]4

InChI

InChI=1S/C24H23N3O/c1-15-7-8-16(2)20(14-15)23(27-21-6-4-5-13-25-21)19-12-11-18-10-9-17(3)26-22(18)24(19)28/h4-14,23,28H,1-3H3,(H,25,27)/p+1/t23-/m0/s1