2-[3-(diethylamino)-2-oxidanyl-propyl]-4-phenyl-isoquinolin-1-one

Systemtic Name: 2-[3-(diethylamino)-2-oxidanyl-propyl]-4-phenyl-isoquinolin-1-one Openeye Name: 2-[3-(diethylamino)-2-hydroxy-propyl]-4-phenyl-isoquinolin-1-one CAS Name: 2-[3-(diethylamino)-2-hydroxypropyl]-4-phenyl-1-isoquinolinone IUPAC Name: 2-[3-(diethylamino)-2-hydroxypropyl]-4-phenylisoquinolin-1-one Traditional Name: 2-[3-(diethylamino)-2-hydroxy-propyl]-4-phenyl-isocarbostyril Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC(CN1C=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)O

Isomeric SMILES

CCN(CC)CC(CN1C=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)O

InChI

InChI=1S/C22H26N2O2/c1-3-23(4-2)14-18(25)15-24-16-21(17-10-6-5-7-11-17)19-12-8-9-13-20(19)22(24)26/h5-13,16,18,25H,3-4,14-15H2,1-2H3