5-[2-(4-octyl-5,6,7,8-tetrahydro-4H-carbazol-1-yl)ethyl]furan-2-carboxylic acid

Systemtic Name: 5-[2-(4-octyl-5,6,7,8-tetrahydro-4H-carbazol-1-yl)ethyl]furan-2-carboxylic acid Openeye Name: 5-[2-(4-octyl-5,6,7,8-tetrahydro-4H-carbazol-1-yl)ethyl]furan-2-carboxylic acid CAS Name: 5-[2-(4-octyl-5,6,7,8-tetrahydro-4H-carbazol-1-yl)ethyl]-2-furancarboxylic acid IUPAC Name: 5-[2-(4-octyl-5,6,7,8-tetrahydro-4H-carbazol-1-yl)ethyl]furan-2-carboxylic acid Traditional Name: 5-[2-(4-octyl-5,6,7,8-tetrahydro-4H-carbazol-1-yl)ethyl]-2-furoic acid Formula: C27H35NO3 MolecularWeight: 421.5717

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1C=CC(=C2C1=C3CCCCC3=N2)CCC4=CC=C(O4)C(=O)O

Isomeric SMILES

CCCCCCCCC1C=CC(=C2C1=C3CCCCC3=N2)CCC4=CC=C(O4)C(=O)O

InChI

InChI=1S/C27H35NO3/c1-2-3-4-5-6-7-10-19-13-14-20(15-16-21-17-18-24(31-21)27(29)30)26-25(19)22-11-8-9-12-23(22)28-26/h13-14,17-19H,2-12,15-16H2,1H3,(H,29,30)