(E)-3-[1-(3-methylbut-2-enyl)indol-5-yl]but-2-enoic acid

Systemtic Name: (E)-3-[1-(3-methylbut-2-enyl)indol-5-yl]but-2-enoic acid Openeye Name: (E)-3-[1-(3-methylbut-2-enyl)indol-5-yl]but-2-enoic acid CAS Name: (E)-3-[1-(3-methylbut-2-enyl)-5-indolyl]-2-butenoic acid IUPAC Name: (E)-3-[1-(3-methylbut-2-enyl)indol-5-yl]but-2-enoic acid Traditional Name: (E)-3-[1-(3-methylbut-2-enyl)indol-5-yl]but-2-enoic acid Formula: C17H19NO2 MolecularWeight: 269.33826

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1C=CC2=C1C=CC(=C2)C(=CC(=O)O)C)C

Isomeric SMILES

CC(=CCN1C=CC2=C1C=CC(=C2)/C(=C/C(=O)O)/C)C

InChI

InChI=1S/C17H19NO2/c1-12(2)6-8-18-9-7-15-11-14(4-5-16(15)18)13(3)10-17(19)20/h4-7,9-11H,8H2,1-3H3,(H,19,20)/b13-10+