(E)-3-(2,5-dimethyl-1H-indol-3-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(2,5-dimethyl-1H-indol-3-yl)prop-2-enoic acid Openeye Name: (E)-3-(2,5-dimethyl-1H-indol-3-yl)prop-2-enoic acid CAS Name: (E)-3-(2,5-dimethyl-1H-indol-3-yl)-2-propenoic acid IUPAC Name: (E)-3-(2,5-dimethyl-1H-indol-3-yl)prop-2-enoic acid Traditional Name: (E)-3-(2,5-dimethyl-1H-indol-3-yl)acrylic acid Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2C=CC(=O)O)C

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2/C=C/C(=O)O)C

InChI

InChI=1S/C13H13NO2/c1-8-3-5-12-11(7-8)10(9(2)14-12)4-6-13(15)16/h3-7,14H,1-2H3,(H,15,16)/b6-4+