2-[1-(isoquinolin-5-ylamino)ethyl]-5-methyl-phenol

Systemtic Name: 2-[1-(isoquinolin-5-ylamino)ethyl]-5-methyl-phenol Openeye Name: 2-[1-(5-isoquinolylamino)ethyl]-5-methyl-phenol CAS Name: 2-[1-(5-isoquinolinylamino)ethyl]-5-methylphenol IUPAC Name: 2-[1-(isoquinolin-5-ylamino)ethyl]-5-methylphenol Traditional Name: 2-[1-(5-isoquinolylamino)ethyl]-5-methyl-phenol Formula: C18H18N2O MolecularWeight: 278.34832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)NC2=CC=CC3=C2C=CN=C3)O

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)NC2=CC=CC3=C2C=CN=C3)O

InChI

InChI=1S/C18H18N2O/c1-12-6-7-15(18(21)10-12)13(2)20-17-5-3-4-14-11-19-9-8-16(14)17/h3-11,13,20-21H,1-2H3