2-chloranyl-4-[3-oxidanylidene-4-[4-(quinolin-2-ylmethoxy)phenyl]-1,2-dihydropyrrol-5-yl]benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-[3-oxidanylidene-4-[4-(quinolin-2-ylmethoxy)phenyl]-1,2-dihydropyrrol-5-yl]benzenecarbonitrile Openeye Name: 2-chloro-4-[3-oxo-4-[4-(2-quinolylmethoxy)phenyl]-1,2-dihydropyrrol-5-yl]benzonitrile CAS Name: 2-chloro-4-[3-oxo-4-[4-(2-quinolinylmethoxy)phenyl]-1,2-dihydropyrrol-5-yl]benzonitrile IUPAC Name: 2-chloro-4-[3-oxo-4-[4-(quinolin-2-ylmethoxy)phenyl]-1,2-dihydropyrrol-5-yl]benzonitrile Traditional Name: 2-chloro-4-[4-keto-3-[4-(2-quinolylmethoxy)phenyl]-2-pyrrolin-2-yl]benzonitrile Formula: C27H18ClN3O2 MolecularWeight: 451.90372

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(N1)C2=CC(=C(C=C2)C#N)Cl)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4

Isomeric SMILES

C1C(=O)C(=C(N1)C2=CC(=C(C=C2)C#N)Cl)C3=CC=C(C=C3)OCC4=NC5=CC=CC=C5C=C4

InChI

InChI=1S/C27H18ClN3O2/c28-23-13-19(5-6-20(23)14-29)27-26(25(32)15-30-27)18-8-11-22(12-9-18)33-16-21-10-7-17-3-1-2-4-24(17)31-21/h1-13,30H,15-16H2