6-[bis(2-hydroxyethyl)amino]-3-butyl-3H-2-benzofuran-1-one

Systemtic Name: 6-[bis(2-hydroxyethyl)amino]-3-butyl-3H-2-benzofuran-1-one Openeye Name: 6-[bis(2-hydroxyethyl)amino]-3-butyl-3H-isobenzofuran-1-one CAS Name: 6-[bis(2-hydroxyethyl)amino]-3-butyl-3H-isobenzofuran-1-one IUPAC Name: 6-[bis(2-hydroxyethyl)amino]-3-butyl-3H-2-benzofuran-1-one Traditional Name: 6-[bis(2-hydroxyethyl)amino]-3-butyl-phthalide Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1C2=C(C=C(C=C2)N(CCO)CCO)C(=O)O1

Isomeric SMILES

CCCCC1C2=C(C=C(C=C2)N(CCO)CCO)C(=O)O1

InChI

InChI=1S/C16H23NO4/c1-2-3-4-15-13-6-5-12(11-14(13)16(20)21-15)17(7-9-18)8-10-19/h5-6,11,15,18-19H,2-4,7-10H2,1H3