(E)-3-[4-[(4-pyridin-4-ylpiperazin-1-yl)methylidene]cyclohexa-2,5-dien-1-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[(4-pyridin-4-ylpiperazin-1-yl)methylidene]cyclohexa-2,5-dien-1-yl]prop-2-enoic acid Openeye Name: (E)-3-[4-[[4-(4-pyridyl)piperazin-1-yl]methylene]cyclohexa-2,5-dien-1-yl]prop-2-enoic acid CAS Name: (E)-3-[4-[(4-pyridin-4-yl-1-piperazinyl)methylidene]-1-cyclohexa-2,5-dienyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[(4-pyridin-4-ylpiperazin-1-yl)methylidene]cyclohexa-2,5-dien-1-yl]prop-2-enoic acid Traditional Name: (E)-3-[4-[[4-(4-pyridyl)piperazino]methylene]cyclohexa-2,5-dien-1-yl]acrylic acid Formula: C19H21N3O2 MolecularWeight: 323.38894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C=C2C=CC(C=C2)C=CC(=O)O)C3=CC=NC=C3

Isomeric SMILES

C1CN(CCN1C=C2C=CC(C=C2)/C=C/C(=O)O)C3=CC=NC=C3

InChI

InChI=1S/C19H21N3O2/c23-19(24)6-5-16-1-3-17(4-2-16)15-21-11-13-22(14-12-21)18-7-9-20-10-8-18/h1-10,15-16H,11-14H2,(H,23,24)/b6-5+,17-15?