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

Systemtic Name: 6-[bis(2-hydroxyethyl)amino]-3-butyl-3H-2-benzofuran-1-one hydrochloride Openeye Name: 6-[bis(2-hydroxyethyl)amino]-3-butyl-3H-isobenzofuran-1-one hydrochloride CAS Name: 6-[bis(2-hydroxyethyl)amino]-3-butyl-3H-isobenzofuran-1-one hydrochloride IUPAC Name: 6-[bis(2-hydroxyethyl)amino]-3-butyl-3H-2-benzofuran-1-one hydrochloride Traditional Name: 6-[bis(2-hydroxyethyl)amino]-3-butyl-phthalide hydrochloride Formula: C16H24ClNO4 MolecularWeight: 329.81906

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H23NO4.ClH/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;1H