(E)-3-[5-(2,3-dihydroindol-1-yl)-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-(2,3-dihydroindol-1-yl)-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-(5-indolin-1-yl-1,3-dimethyl-pyrazol-4-yl)prop-2-enoic acid CAS Name: (E)-3-[5-(2,3-dihydroindol-1-yl)-1,3-dimethyl-4-pyrazolyl]-2-propenoic acid IUPAC Name: (E)-3-[5-(2,3-dihydroindol-1-yl)-1,3-dimethylpyrazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-(5-indolin-1-yl-1,3-dimethyl-pyrazol-4-yl)acrylic acid Formula: C16H17N3O2 MolecularWeight: 283.32508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)O)N2CCC3=CC=CC=C32)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)O)N2CCC3=CC=CC=C32)C

InChI

InChI=1S/C16H17N3O2/c1-11-13(7-8-15(20)21)16(18(2)17-11)19-10-9-12-5-3-4-6-14(12)19/h3-8H,9-10H2,1-2H3,(H,20,21)/b8-7+