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2,3-bis(butylsulfanyl)indolizine-6,7,8-tricarboxylic acid

2,3-bis(butylsulfanyl)indolizine-6,7,8-tricarboxylic acid

Systemtic Name:2,3-bis(butylsulfanyl)indolizine-6,7,8-tricarboxylic acid
Openeye Name:2,3-bis(butylsulfanyl)indolizine-6,7,8-tricarboxylic acid
CAS Name:2,3-bis(butylthio)indolizine-6,7,8-tricarboxylic acid
IUPAC Name:2,3-bis(butylsulfanyl)indolizine-6,7,8-tricarboxylic acid
Traditional Name:2,3-bis(butylthio)indolizine-6,7,8-tricarboxylic acid
Formula: C19H23NO6S2
MolecularWeight: 425.51902
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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(N2C=C(C(=C(C2=C1)C(=O)O)C(=O)O)C(=O)O)SCCCC


Isomeric SMILES

CCCCSC1=C(N2C=C(C(=C(C2=C1)C(=O)O)C(=O)O)C(=O)O)SCCCC


InChI

InChI=1S/C19H23NO6S2/c1-3-5-7-27-13-9-12-15(19(25)26)14(18(23)24)11(17(21)22)10-20(12)16(13)28-8-6-4-2/h9-10H,3-8H2,1-2H3,(H,21,22)(H,23,24)(H,25,26)


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