6-[(E)-3-(oxidanylamino)prop-1-enyl]-2-(phenylmethyl)isoquinolin-1-one

Systemtic Name: 6-[(E)-3-(oxidanylamino)prop-1-enyl]-2-(phenylmethyl)isoquinolin-1-one Openeye Name: 2-benzyl-6-[(E)-3-(hydroxyamino)prop-1-enyl]isoquinolin-1-one CAS Name: 6-[(E)-3-(hydroxyamino)prop-1-enyl]-2-(phenylmethyl)-1-isoquinolinone IUPAC Name: 2-benzyl-6-[(E)-3-(hydroxyamino)prop-1-enyl]isoquinolin-1-one Traditional Name: 2-benzyl-6-[(E)-3-(hydroxyamino)prop-1-enyl]isocarbostyril Formula: C19H18N2O2 MolecularWeight: 306.35842

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC3=C(C2=O)C=CC(=C3)C=CCNO

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC3=C(C2=O)C=CC(=C3)/C=C/CNO

InChI

InChI=1S/C19H18N2O2/c22-19-18-9-8-15(7-4-11-20-23)13-17(18)10-12-21(19)14-16-5-2-1-3-6-16/h1-10,12-13,20,23H,11,14H2/b7-4+