(E)-3-[4-[4-[4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenyl]-2-phenanthren-9-yl-1H-imidazol-5-yl]phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[4-[4-[4-[(E)-3-oxidanyl-3-oxidanylidene-prop-1-enyl]phenyl]-2-phenanthren-9-yl-1H-imidazol-5-yl]phenyl]prop-2-enoic acid Openeye Name: (E)-3-[4-[4-[4-[(E)-3-hydroxy-3-oxo-prop-1-enyl]phenyl]-2-(9-phenanthryl)-1H-imidazol-5-yl]phenyl]prop-2-enoic acid CAS Name: (E)-3-[4-[4-[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]phenyl]-2-(9-phenanthrenyl)-1H-imidazol-5-yl]phenyl]-2-propenoic acid IUPAC Name: (E)-3-[4-[4-[4-[(E)-3-hydroxy-3-oxoprop-1-enyl]phenyl]-2-phenanthren-9-yl-1H-imidazol-5-yl]phenyl]prop-2-enoic acid Traditional Name: (E)-3-[4-[4-[4-[(E)-3-hydroxy-3-keto-prop-1-enyl]phenyl]-2-(9-phenanthryl)-1H-imidazol-5-yl]phenyl]acrylic acid Formula: C35H24N2O4 MolecularWeight: 536.57606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C4=NC(=C(N4)C5=CC=C(C=C5)C=CC(=O)O)C6=CC=C(C=C6)C=CC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C3=CC=CC=C23)C4=NC(=C(N4)C5=CC=C(C=C5)/C=C/C(=O)O)C6=CC=C(C=C6)/C=C/C(=O)O

InChI

InChI=1S/C35H24N2O4/c38-31(39)19-13-22-9-15-24(16-10-22)33-34(25-17-11-23(12-18-25)14-20-32(40)41)37-35(36-33)30-21-26-5-1-2-6-27(26)28-7-3-4-8-29(28)30/h1-21H,(H,36,37)(H,38,39)(H,40,41)/b19-13+,20-14+