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2-(7-butyl-3-oxidanylidene-1H-isoindol-2-yl)pentanedioic acid

2-(7-butyl-3-oxidanylidene-1H-isoindol-2-yl)pentanedioic acid

Systemtic Name:2-(7-butyl-3-oxidanylidene-1H-isoindol-2-yl)pentanedioic acid
Openeye Name:2-(4-butyl-1-oxo-isoindolin-2-yl)pentanedioic acid
CAS Name:2-(7-butyl-3-oxo-1H-isoindol-2-yl)pentanedioic acid
IUPAC Name:2-(7-butyl-3-oxo-1H-isoindol-2-yl)pentanedioic acid
Traditional Name:2-(4-butyl-1-keto-isoindolin-2-yl)glutaric acid
Formula: C17H21NO5
MolecularWeight: 319.35234
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC2=C1CN(C2=O)C(CCC(=O)O)C(=O)O


Isomeric SMILES

CCCCC1=CC=CC2=C1CN(C2=O)C(CCC(=O)O)C(=O)O


InChI

InChI=1S/C17H21NO5/c1-2-3-5-11-6-4-7-12-13(11)10-18(16(12)21)14(17(22)23)8-9-15(19)20/h4,6-7,14H,2-3,5,8-10H2,1H3,(H,19,20)(H,22,23)


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