4-[[2-(furan-3-ylmethyl)phenyl]amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile

Systemtic Name: 4-[[2-(furan-3-ylmethyl)phenyl]amino]-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromene-6-carbonitrile Openeye Name: 4-[2-(3-furylmethyl)anilino]-3-hydroxy-2,2-dimethyl-chromane-6-carbonitrile CAS Name: 4-[2-(3-furanylmethyl)anilino]-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-6-carbonitrile IUPAC Name: 4-[2-(furan-3-ylmethyl)anilino]-3-hydroxy-2,2-dimethyl-3,4-dihydrochromene-6-carbonitrile Traditional Name: 4-[2-(3-furfuryl)anilino]-3-hydroxy-2,2-dimethyl-chroman-6-carbonitrile Formula: C23H22N2O3 MolecularWeight: 374.43238

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=CC=CC=C3CC4=COC=C4)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC3=CC=CC=C3CC4=COC=C4)O)C

InChI

InChI=1S/C23H22N2O3/c1-23(2)22(26)21(18-12-15(13-24)7-8-20(18)28-23)25-19-6-4-3-5-17(19)11-16-9-10-27-14-16/h3-10,12,14,21-22,25-26H,11H2,1-2H3