(E)-3-[1-(1-pyridin-3-ylethyl)indol-2-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[1-(1-pyridin-3-ylethyl)indol-2-yl]prop-2-enoic acid Openeye Name: (E)-3-[1-[1-(3-pyridyl)ethyl]indol-2-yl]prop-2-enoic acid CAS Name: (E)-3-[1-[1-(3-pyridinyl)ethyl]-2-indolyl]-2-propenoic acid IUPAC Name: (E)-3-[1-(1-pyridin-3-ylethyl)indol-2-yl]prop-2-enoic acid Traditional Name: (E)-3-[1-[1-(3-pyridyl)ethyl]indol-2-yl]acrylic acid Formula: C18H16N2O2 MolecularWeight: 292.33184

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)N2C3=CC=CC=C3C=C2C=CC(=O)O

Isomeric SMILES

CC(C1=CN=CC=C1)N2C3=CC=CC=C3C=C2/C=C/C(=O)O

InChI

InChI=1S/C18H16N2O2/c1-13(15-6-4-10-19-12-15)20-16(8-9-18(21)22)11-14-5-2-3-7-17(14)20/h2-13H,1H3,(H,21,22)/b9-8+