5-[4-oxidanylidene-2-phenyl-3-(phenylcarbonyl)chromen-7-yl]oxypentanenitrile

Systemtic Name: 5-[4-oxidanylidene-2-phenyl-3-(phenylcarbonyl)chromen-7-yl]oxypentanenitrile Openeye Name: 5-(3-benzoyl-4-oxo-2-phenyl-chromen-7-yl)oxypentanenitrile CAS Name: 5-[(3-benzoyl-4-oxo-2-phenyl-1-benzopyran-7-yl)oxy]pentanenitrile IUPAC Name: 5-(3-benzoyl-4-oxo-2-phenylchromen-7-yl)oxypentanenitrile Traditional Name: 5-(3-benzoyl-4-keto-2-phenyl-chromen-7-yl)oxyvaleronitrile Formula: C27H21NO4 MolecularWeight: 423.45994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3)OCCCCC#N)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3)OCCCCC#N)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H21NO4/c28-16-8-3-9-17-31-21-14-15-22-23(18-21)32-27(20-12-6-2-7-13-20)24(26(22)30)25(29)19-10-4-1-5-11-19/h1-2,4-7,10-15,18H,3,8-9,17H2