4-phenyl-2-(2-pyrrolidin-1-ylpropyl)isoquinolin-1-one

Systemtic Name: 4-phenyl-2-(2-pyrrolidin-1-ylpropyl)isoquinolin-1-one Openeye Name: 4-phenyl-2-(2-pyrrolidin-1-ylpropyl)isoquinolin-1-one CAS Name: 4-phenyl-2-[2-(1-pyrrolidinyl)propyl]-1-isoquinolinone IUPAC Name: 4-phenyl-2-(2-pyrrolidin-1-ylpropyl)isoquinolin-1-one Traditional Name: 4-phenyl-2-(2-pyrrolidinopropyl)isocarbostyril Formula: C22H24N2O MolecularWeight: 332.43876

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)N4CCCC4

Isomeric SMILES

CC(CN1C=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3)N4CCCC4

InChI

InChI=1S/C22H24N2O/c1-17(23-13-7-8-14-23)15-24-16-21(18-9-3-2-4-10-18)19-11-5-6-12-20(19)22(24)25/h2-6,9-12,16-17H,7-8,13-15H2,1H3