N-[4-[4-[bis(2-hydroxyethyl)amino]phenyl]isoquinolin-3-yl]ethanamide

Systemtic Name: N-[4-[4-[bis(2-hydroxyethyl)amino]phenyl]isoquinolin-3-yl]ethanamide Openeye Name: N-[4-[4-[bis(2-hydroxyethyl)amino]phenyl]-3-isoquinolyl]acetamide CAS Name: N-[4-[4-[bis(2-hydroxyethyl)amino]phenyl]-3-isoquinolinyl]acetamide IUPAC Name: N-[4-[4-[bis(2-hydroxyethyl)amino]phenyl]isoquinolin-3-yl]acetamide Traditional Name: N-[4-[4-[bis(2-hydroxyethyl)amino]phenyl]-3-isoquinolyl]acetamide Formula: C21H23N3O3 MolecularWeight: 365.42562

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C2=CC=CC=C2C=N1)C3=CC=C(C=C3)N(CCO)CCO

Isomeric SMILES

CC(=O)NC1=C(C2=CC=CC=C2C=N1)C3=CC=C(C=C3)N(CCO)CCO

InChI

InChI=1S/C21H23N3O3/c1-15(27)23-21-20(19-5-3-2-4-17(19)14-22-21)16-6-8-18(9-7-16)24(10-12-25)11-13-26/h2-9,14,25-26H,10-13H2,1H3,(H,22,23,27)