5-[(9-octyl-5,6,7,8-tetrahydrocarbazol-3-yl)methyl]furan-2-carboxylic acid

Systemtic Name: 5-[(9-octyl-5,6,7,8-tetrahydrocarbazol-3-yl)methyl]furan-2-carboxylic acid Openeye Name: 5-[(9-octyl-5,6,7,8-tetrahydrocarbazol-3-yl)methyl]furan-2-carboxylic acid CAS Name: 5-[(9-octyl-5,6,7,8-tetrahydrocarbazol-3-yl)methyl]-2-furancarboxylic acid IUPAC Name: 5-[(9-octyl-5,6,7,8-tetrahydrocarbazol-3-yl)methyl]furan-2-carboxylic acid Traditional Name: 5-[(9-octyl-5,6,7,8-tetrahydrocarbazol-3-yl)methyl]-2-furoic acid Formula: C26H33NO3 MolecularWeight: 407.54512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C2=C(CCCC2)C3=C1C=CC(=C3)CC4=CC=C(O4)C(=O)O

Isomeric SMILES

CCCCCCCCN1C2=C(CCCC2)C3=C1C=CC(=C3)CC4=CC=C(O4)C(=O)O

InChI

InChI=1S/C26H33NO3/c1-2-3-4-5-6-9-16-27-23-11-8-7-10-21(23)22-18-19(12-14-24(22)27)17-20-13-15-25(30-20)26(28)29/h12-15,18H,2-11,16-17H2,1H3,(H,28,29)