3-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one

Systemtic Name: 3-[2-(3-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]-3H-2-benzofuran-1-one Openeye Name: 3-[2-(3-methyl-1-piperidyl)-2-oxo-ethyl]-3H-isobenzofuran-1-one CAS Name: 3-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]-3H-isobenzofuran-1-one IUPAC Name: 3-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]-3H-2-benzofuran-1-one Traditional Name: 3-[2-keto-2-(3-methylpiperidino)ethyl]phthalide Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CC2C3=CC=CC=C3C(=O)O2

Isomeric SMILES

CC1CCCN(C1)C(=O)CC2C3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C16H19NO3/c1-11-5-4-8-17(10-11)15(18)9-14-12-6-2-3-7-13(12)16(19)20-14/h2-3,6-7,11,14H,4-5,8-10H2,1H3