2-methyl-3-[(E)-3-phenylprop-2-enoyl]azulene-1-carbonitrile

Systemtic Name: 2-methyl-3-[(E)-3-phenylprop-2-enoyl]azulene-1-carbonitrile Openeye Name: 2-methyl-3-[(E)-3-phenylprop-2-enoyl]azulene-1-carbonitrile CAS Name: 2-methyl-3-[(E)-1-oxo-3-phenylprop-2-enyl]-1-azulenecarbonitrile IUPAC Name: 2-methyl-3-[(E)-3-phenylprop-2-enoyl]azulene-1-carbonitrile Traditional Name: 2-methyl-3-[(E)-3-phenylacryloyl]azulene-1-carbonitrile Formula: C21H15NO MolecularWeight: 297.3499

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=CC2=C1C(=O)C=CC3=CC=CC=C3)C#N

Isomeric SMILES

CC1=C(C2=CC=CC=CC2=C1C(=O)/C=C/C3=CC=CC=C3)C#N

InChI

InChI=1S/C21H15NO/c1-15-19(14-22)17-10-6-3-7-11-18(17)21(15)20(23)13-12-16-8-4-2-5-9-16/h2-13H,1H3/b13-12+