(E)-3-(1-azanylisoquinolin-6-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(1-azanylisoquinolin-6-yl)prop-2-enoic acid Openeye Name: (E)-3-(1-amino-6-isoquinolyl)prop-2-enoic acid CAS Name: (E)-3-(1-amino-6-isoquinolinyl)-2-propenoic acid IUPAC Name: (E)-3-(1-aminoisoquinolin-6-yl)prop-2-enoic acid Traditional Name: (E)-3-(1-amino-6-isoquinolyl)acrylic acid Formula: C12H10N2O2 MolecularWeight: 214.22

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2N)C=C1C=CC(=O)O

Isomeric SMILES

C1=CC2=C(C=CN=C2N)C=C1/C=C/C(=O)O

InChI

InChI=1S/C12H10N2O2/c13-12-10-3-1-8(2-4-11(15)16)7-9(10)5-6-14-12/h1-7H,(H2,13,14)(H,15,16)/b4-2+