4-[5-[(E)-hydroxyiminomethyl]imidazol-1-yl]-3,3-dimethyl-4H-isochromen-1-one

Systemtic Name: 4-[5-[(E)-hydroxyiminomethyl]imidazol-1-yl]-3,3-dimethyl-4H-isochromen-1-one Openeye Name: (4E)-3-(3,3-dimethyl-1-oxo-isochroman-4-yl)imidazole-4-carbaldehyde oxime CAS Name: (4E)-3-(3,3-dimethyl-1-oxo-3,4-dihydro-1H-2-benzopyran-4-yl)-4-imidazolecarboxaldehyde oxime IUPAC Name: 4-[5-[(E)-hydroxyiminomethyl]imidazol-1-yl]-3,3-dimethyl-4H-isochromen-1-one Traditional Name: (4E)-3-(1-keto-3,3-dimethyl-isochroman-4-yl)imidazole-4-carbaldehyde oxime Formula: C15H15N3O3 MolecularWeight: 285.2979

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C2=CC=CC=C2C(=O)O1)N3C=NC=C3C=NO)C

Isomeric SMILES

CC1(C(C2=CC=CC=C2C(=O)O1)N3C=NC=C3/C=N/O)C

InChI

InChI=1S/C15H15N3O3/c1-15(2)13(18-9-16-7-10(18)8-17-20)11-5-3-4-6-12(11)14(19)21-15/h3-9,13,20H,1-2H3/b17-8+