5-chloranyl-2-oxidanyl-3-[(E)-3-[3-[(E)-2-quinolin-2-ylethenyl]phenyl]prop-2-enoyl]benzenecarbonitrile

Systemtic Name: 5-chloranyl-2-oxidanyl-3-[(E)-3-[3-[(E)-2-quinolin-2-ylethenyl]phenyl]prop-2-enoyl]benzenecarbonitrile Openeye Name: 5-chloro-2-hydroxy-3-[(E)-3-[3-[(E)-2-(2-quinolyl)vinyl]phenyl]prop-2-enoyl]benzonitrile CAS Name: 5-chloro-2-hydroxy-3-[(E)-1-oxo-3-[3-[(E)-2-(2-quinolinyl)ethenyl]phenyl]prop-2-enyl]benzonitrile IUPAC Name: 5-chloro-2-hydroxy-3-[(E)-3-[3-[(E)-2-quinolin-2-ylethenyl]phenyl]prop-2-enoyl]benzonitrile Traditional Name: 5-chloro-2-hydroxy-3-[(E)-3-[3-[(E)-2-(2-quinolyl)vinyl]phenyl]acryloyl]benzonitrile Formula: C27H17ClN2O2 MolecularWeight: 436.88908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)C=CC3=CC(=CC=C3)C=CC(=O)C4=C(C(=CC(=C4)Cl)C#N)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)/C=C/C3=CC(=CC=C3)/C=C/C(=O)C4=C(C(=CC(=C4)Cl)C#N)O

InChI

InChI=1S/C27H17ClN2O2/c28-22-15-21(17-29)27(32)24(16-22)26(31)13-9-19-5-3-4-18(14-19)8-11-23-12-10-20-6-1-2-7-25(20)30-23/h1-16,32H/b11-8+,13-9+