4-chloranyl-3-phenylmethoxy-isochromen-1-one

Systemtic Name: 4-chloranyl-3-phenylmethoxy-isochromen-1-one Openeye Name: 3-benzyloxy-4-chloro-isochromen-1-one CAS Name: 4-chloro-3-phenylmethoxy-2-benzopyran-1-one IUPAC Name: 4-chloro-3-phenylmethoxyisochromen-1-one Traditional Name: 3-benzoxy-4-chloro-isocoumarin Formula: C16H11ClO3 MolecularWeight: 286.70974

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=C(C3=CC=CC=C3C(=O)O2)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC2=C(C3=CC=CC=C3C(=O)O2)Cl

InChI

InChI=1S/C16H11ClO3/c17-14-12-8-4-5-9-13(12)15(18)20-16(14)19-10-11-6-2-1-3-7-11/h1-9H,10H2