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7-(1H-indol-3-yl)heptylazanium; 6-oxidanyl-6-oxidanylidene-hexanoate

7-(1H-indol-3-yl)heptylazanium; 6-oxidanyl-6-oxidanylidene-hexanoate

Systemtic Name:7-(1H-indol-3-yl)heptylazanium; 6-oxidanyl-6-oxidanylidene-hexanoate
Openeye Name:6-hydroxy-6-oxo-hexanoate; 7-(1H-indol-3-yl)heptylammonium
CAS Name:6-hydroxy-6-oxohexanoate; 7-(1H-indol-3-yl)heptylammonium
IUPAC Name:6-hydroxy-6-oxohexanoate; 7-(1H-indol-3-yl)heptylazanium
Traditional Name:6-hydroxy-6-keto-hexanoate; 7-(1H-indol-3-yl)heptylammonium
Formula: C21H32N2O4
MolecularWeight: 376.48978
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)CCCCCCC[NH3+].C(CCC(=O)[O-])CC(=O)O


Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)CCCCCCC[NH3+].C(CCC(=O)[O-])CC(=O)O


InChI

InChI=1S/C15H22N2.C6H10O4/c16-11-7-3-1-2-4-8-13-12-17-15-10-6-5-9-14(13)15;7-5(8)3-1-2-4-6(9)10/h5-6,9-10,12,17H,1-4,7-8,11,16H2;1-4H2,(H,7,8)(H,9,10)


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