3-(4-aminophenyl)-2-(5-oxidanylpentyl)isoquinolin-1-one

Systemtic Name: 3-(4-aminophenyl)-2-(5-oxidanylpentyl)isoquinolin-1-one Openeye Name: 3-(4-aminophenyl)-2-(5-hydroxypentyl)isoquinolin-1-one CAS Name: 3-(4-aminophenyl)-2-(5-hydroxypentyl)-1-isoquinolinone IUPAC Name: 3-(4-aminophenyl)-2-(5-hydroxypentyl)isoquinolin-1-one Traditional Name: 3-(4-aminophenyl)-2-(5-hydroxypentyl)isocarbostyril Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N2O2/c21-17-10-8-15(9-11-17)19-14-16-6-2-3-7-18(16)20(24)22(19)12-4-1-5-13-23/h2-3,6-11,14,23H,1,4-5,12-13,21H2