2-[4-oxidanylidene-7-[[4-(quinolin-2-ylmethoxy)phenoxy]methyl]chromen-2-yl]ethanenitrile

Systemtic Name: 2-[4-oxidanylidene-7-[[4-(quinolin-2-ylmethoxy)phenoxy]methyl]chromen-2-yl]ethanenitrile Openeye Name: 2-[4-oxo-7-[[4-(2-quinolylmethoxy)phenoxy]methyl]chromen-2-yl]acetonitrile CAS Name: 2-[4-oxo-7-[[4-(2-quinolinylmethoxy)phenoxy]methyl]-1-benzopyran-2-yl]acetonitrile IUPAC Name: 2-[4-oxo-7-[[4-(quinolin-2-ylmethoxy)phenoxy]methyl]chromen-2-yl]acetonitrile Traditional Name: 2-[4-keto-7-[[4-(2-quinolylmethoxy)phenoxy]methyl]chromen-2-yl]acetonitrile Formula: C28H20N2O4 MolecularWeight: 448.4694

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)OCC4=CC5=C(C=C4)C(=O)C=C(O5)CC#N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)COC3=CC=C(C=C3)OCC4=CC5=C(C=C4)C(=O)C=C(O5)CC#N

InChI

InChI=1S/C28H20N2O4/c29-14-13-24-16-27(31)25-12-5-19(15-28(25)34-24)17-32-22-8-10-23(11-9-22)33-18-21-7-6-20-3-1-2-4-26(20)30-21/h1-12,15-16H,13,17-18H2