2-[5-[[(3R)-3-(isoquinolin-5-ylamino)pyrrolidin-1-yl]methyl]-2-methoxy-phenoxy]ethanol

Systemtic Name: 2-[5-[[(3R)-3-(isoquinolin-5-ylamino)pyrrolidin-1-yl]methyl]-2-methoxy-phenoxy]ethanol Openeye Name: 2-[5-[[(3R)-3-(5-isoquinolylamino)pyrrolidin-1-yl]methyl]-2-methoxy-phenoxy]ethanol CAS Name: 2-[5-[[(3R)-3-(5-isoquinolinylamino)-1-pyrrolidinyl]methyl]-2-methoxyphenoxy]ethanol IUPAC Name: 2-[5-[[(3R)-3-(isoquinolin-5-ylamino)pyrrolidin-1-yl]methyl]-2-methoxyphenoxy]ethanol Traditional Name: 2-[5-[[(3R)-3-(5-isoquinolylamino)pyrrolidino]methyl]-2-methoxy-phenoxy]ethanol Formula: C23H27N3O3 MolecularWeight: 393.47878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCC(C2)NC3=CC=CC4=C3C=CN=C4)OCCO

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CC[C@H](C2)NC3=CC=CC4=C3C=CN=C4)OCCO

InChI

InChI=1S/C23H27N3O3/c1-28-22-6-5-17(13-23(22)29-12-11-27)15-26-10-8-19(16-26)25-21-4-2-3-18-14-24-9-7-20(18)21/h2-7,9,13-14,19,25,27H,8,10-12,15-16H2,1H3/t19-/m1/s1