(6E)-6-[(2H-benzotriazol-5-ylamino)methylidene]-2-prop-2-enyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-6-[(2H-benzotriazol-5-ylamino)methylidene]-2-prop-2-enyl-cyclohexa-2,4-dien-1-one Openeye Name: (6E)-2-allyl-6-[(2H-benzotriazol-5-ylamino)methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-6-[(2H-benzotriazol-5-ylamino)methylidene]-2-prop-2-enyl-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-6-[(2H-benzotriazol-5-ylamino)methylidene]-2-prop-2-enylcyclohexa-2,4-dien-1-one Traditional Name: (6E)-2-allyl-6-[(2H-benzotriazol-5-ylamino)methylene]cyclohexa-2,4-dien-1-one Formula: C16H14N4O MolecularWeight: 278.30856

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC=CC(=CNC2=CC3=NNN=C3C=C2)C1=O

Isomeric SMILES

C=CCC1=CC=C/C(=C\NC2=CC3=NNN=C3C=C2)/C1=O

InChI

InChI=1S/C16H14N4O/c1-2-4-11-5-3-6-12(16(11)21)10-17-13-7-8-14-15(9-13)19-20-18-14/h2-3,5-10,17H,1,4H2,(H,18,19,20)/b12-10+