(E)-3-(1,5-dimethyl-2-phenyl-pyrrolo[2,3-b]pyridin-3-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(1,5-dimethyl-2-phenyl-pyrrolo[2,3-b]pyridin-3-yl)prop-2-enoic acid Openeye Name: (E)-3-(1,5-dimethyl-2-phenyl-pyrrolo[2,3-b]pyridin-3-yl)prop-2-enoic acid CAS Name: (E)-3-(1,5-dimethyl-2-phenyl-3-pyrrolo[2,3-b]pyridinyl)-2-propenoic acid IUPAC Name: (E)-3-(1,5-dimethyl-2-phenylpyrrolo[2,3-b]pyridin-3-yl)prop-2-enoic acid Traditional Name: (E)-3-(1,5-dimethyl-2-phenyl-pyrrolo[2,3-b]pyridin-3-yl)acrylic acid Formula: C18H16N2O2 MolecularWeight: 292.33184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C(=C(N2C)C3=CC=CC=C3)C=CC(=O)O

Isomeric SMILES

CC1=CN=C2C(=C1)C(=C(N2C)C3=CC=CC=C3)/C=C/C(=O)O

InChI

InChI=1S/C18H16N2O2/c1-12-10-15-14(8-9-16(21)22)17(13-6-4-3-5-7-13)20(2)18(15)19-11-12/h3-11H,1-2H3,(H,21,22)/b9-8+