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

Systemtic Name: 2-[3-[[(3R)-3-(isoquinolin-5-ylamino)pyrrolidin-1-yl]methyl]phenoxy]ethanol Openeye Name: 2-[3-[[(3R)-3-(5-isoquinolylamino)pyrrolidin-1-yl]methyl]phenoxy]ethanol CAS Name: 2-[3-[[(3R)-3-(5-isoquinolinylamino)-1-pyrrolidinyl]methyl]phenoxy]ethanol IUPAC Name: 2-[3-[[(3R)-3-(isoquinolin-5-ylamino)pyrrolidin-1-yl]methyl]phenoxy]ethanol Traditional Name: 2-[3-[[(3R)-3-(5-isoquinolylamino)pyrrolidino]methyl]phenoxy]ethanol Formula: C22H25N3O2 MolecularWeight: 363.4528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC2=CC=CC3=C2C=CN=C3)CC4=CC(=CC=C4)OCCO

Isomeric SMILES

C1CN(C[C@@H]1NC2=CC=CC3=C2C=CN=C3)CC4=CC(=CC=C4)OCCO

InChI

InChI=1S/C22H25N3O2/c26-11-12-27-20-5-1-3-17(13-20)15-25-10-8-19(16-25)24-22-6-2-4-18-14-23-9-7-21(18)22/h1-7,9,13-14,19,24,26H,8,10-12,15-16H2/t19-/m1/s1