(E)-3-(1-heptylindol-5-yl)but-2-enoic acid

Systemtic Name: (E)-3-(1-heptylindol-5-yl)but-2-enoic acid Openeye Name: (E)-3-(1-heptylindol-5-yl)but-2-enoic acid CAS Name: (E)-3-(1-heptyl-5-indolyl)-2-butenoic acid IUPAC Name: (E)-3-(1-heptylindol-5-yl)but-2-enoic acid Traditional Name: (E)-3-(1-heptylindol-5-yl)but-2-enoic acid Formula: C19H25NO2 MolecularWeight: 299.4073

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C=CC2=C1C=CC(=C2)C(=CC(=O)O)C

Isomeric SMILES

CCCCCCCN1C=CC2=C1C=CC(=C2)/C(=C/C(=O)O)/C

InChI

InChI=1S/C19H25NO2/c1-3-4-5-6-7-11-20-12-10-17-14-16(8-9-18(17)20)15(2)13-19(21)22/h8-10,12-14H,3-7,11H2,1-2H3,(H,21,22)/b15-13+