7-[(R)-(3-ethoxy-4-methoxy-phenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol

Systemtic Name: 7-[(R)-(3-ethoxy-4-methoxy-phenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol Openeye Name: 7-[(R)-(3-ethoxy-4-methoxy-phenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol CAS Name: 7-[(R)-(3-ethoxy-4-methoxyphenyl)-(2-pyridin-1-iumylamino)methyl]-8-quinolinol IUPAC Name: 7-[(R)-(3-ethoxy-4-methoxyphenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol Traditional Name: 7-[(R)-(3-ethoxy-4-methoxy-phenyl)-(pyridin-1-ium-2-ylamino)methyl]quinolin-8-ol Formula: C24H24N3O3+ MolecularWeight: 402.46566

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(C2=C(C3=C(C=CC=N3)C=C2)O)NC4=CC=CC=[NH+]4)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)[C@H](C2=C(C3=C(C=CC=N3)C=C2)O)NC4=CC=CC=[NH+]4)OC

InChI

InChI=1S/C24H23N3O3/c1-3-30-20-15-17(10-12-19(20)29-2)22(27-21-8-4-5-13-25-21)18-11-9-16-7-6-14-26-23(16)24(18)28/h4-15,22,28H,3H2,1-2H3,(H,25,27)/p+1/t22-/m1/s1