3-(4-aminophenyl)-2-(4-oxidanylbutyl)isoquinolin-1-one

Systemtic Name: 3-(4-aminophenyl)-2-(4-oxidanylbutyl)isoquinolin-1-one Openeye Name: 3-(4-aminophenyl)-2-(4-hydroxybutyl)isoquinolin-1-one CAS Name: 3-(4-aminophenyl)-2-(4-hydroxybutyl)-1-isoquinolinone IUPAC Name: 3-(4-aminophenyl)-2-(4-hydroxybutyl)isoquinolin-1-one Traditional Name: 3-(4-aminophenyl)-2-(4-hydroxybutyl)isocarbostyril Formula: C19H20N2O2 MolecularWeight: 308.3743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(N(C2=O)CCCCO)C3=CC=C(C=C3)N

Isomeric SMILES

C1=CC=C2C(=C1)C=C(N(C2=O)CCCCO)C3=CC=C(C=C3)N

InChI

InChI=1S/C19H20N2O2/c20-16-9-7-14(8-10-16)18-13-15-5-1-2-6-17(15)19(23)21(18)11-3-4-12-22/h1-2,5-10,13,22H,3-4,11-12,20H2