ethanedioic acid; 2-propylspiro[1H-isoindole-3,4'-6,7-dihydro-5H-1-benzothiophene]

Systemtic Name: ethanedioic acid; 2-propylspiro[1H-isoindole-3,4'-6,7-dihydro-5H-1-benzothiophene] Openeye Name: oxalic acid; 2'-propylspiro[6,7-dihydro-5H-benzothiophene-4,1'-isoindoline] CAS Name: oxalic acid; 2-propylspiro[1H-isoindole-3,4'-6,7-dihydro-5H-1-benzothiophene] IUPAC Name: oxalic acid; 2-propylspiro[1H-isoindole-3,4'-6,7-dihydro-5H-1-benzothiophene] Traditional Name: oxalic acid; 2'-propylspiro[6,7-dihydro-5H-benzothiophene-4,1'-isoindoline] Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CC2=CC=CC=C2C13CCCC4=C3C=CS4.C(=O)(C(=O)O)O

Isomeric SMILES

CCCN1CC2=CC=CC=C2C13CCCC4=C3C=CS4.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H21NS.C2H2O4/c1-2-11-19-13-14-6-3-4-7-15(14)18(19)10-5-8-17-16(18)9-12-20-17;3-1(4)2(5)6/h3-4,6-7,9,12H,2,5,8,10-11,13H2,1H3;(H,3,4)(H,5,6)