(6E)-6-[(isoquinolin-5-ylamino)methylidene]-3-propoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[(isoquinolin-5-ylamino)methylidene]-3-propoxy-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-6-[(5-isoquinolylamino)methylene]-3-propoxy-cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[(5-isoquinolinylamino)methylidene]-3-propoxy-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[(isoquinolin-5-ylamino)methylidene]-3-propoxycyclohexa-2,4-dien-1-one Traditional Name: (6E)-6-[(5-isoquinolylamino)methylene]-3-propoxy-cyclohexa-2,4-dien-1-one Formula: C19H18N2O2 MolecularWeight: 306.35842

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)C(=CNC2=CC=CC3=C2C=CN=C3)C=C1

Isomeric SMILES

CCCOC1=CC(=O)/C(=C/NC2=CC=CC3=C2C=CN=C3)/C=C1

InChI

InChI=1S/C19H18N2O2/c1-2-10-23-16-7-6-15(19(22)11-16)13-21-18-5-3-4-14-12-20-9-8-17(14)18/h3-9,11-13,21H,2,10H2,1H3/b15-13+