(E)-3-[2-methyl-3-(pyridin-3-ylmethyl)-1H-indol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-methyl-3-(pyridin-3-ylmethyl)-1H-indol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[2-methyl-3-(3-pyridylmethyl)-1H-indol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[2-methyl-3-(3-pyridinylmethyl)-1H-indol-4-yl]-2-propenoic acid IUPAC Name: (E)-3-[2-methyl-3-(pyridin-3-ylmethyl)-1H-indol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[2-methyl-3-(3-pyridylmethyl)-1H-indol-4-yl]acrylic acid Formula: C18H16N2O2 MolecularWeight: 292.33184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=CC=C2N1)C=CC(=O)O)CC3=CN=CC=C3

Isomeric SMILES

CC1=C(C2=C(C=CC=C2N1)/C=C/C(=O)O)CC3=CN=CC=C3

InChI

InChI=1S/C18H16N2O2/c1-12-15(10-13-4-3-9-19-11-13)18-14(7-8-17(21)22)5-2-6-16(18)20-12/h2-9,11,20H,10H2,1H3,(H,21,22)/b8-7+