(E)-3-(2-chloranyl-1-methyl-indol-3-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(2-chloranyl-1-methyl-indol-3-yl)prop-2-enoic acid Openeye Name: (E)-3-(2-chloro-1-methyl-indol-3-yl)prop-2-enoic acid CAS Name: (E)-3-(2-chloro-1-methyl-3-indolyl)-2-propenoic acid IUPAC Name: (E)-3-(2-chloro-1-methylindol-3-yl)prop-2-enoic acid Traditional Name: (E)-3-(2-chloro-1-methyl-indol-3-yl)acrylic acid Formula: C12H10ClNO2 MolecularWeight: 235.6663

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=C1Cl)C=CC(=O)O

Isomeric SMILES

CN1C2=CC=CC=C2C(=C1Cl)/C=C/C(=O)O

InChI

InChI=1S/C12H10ClNO2/c1-14-10-5-3-2-4-8(10)9(12(14)13)6-7-11(15)16/h2-7H,1H3,(H,15,16)/b7-6+