3-[[3-(2-oxidanyloxan-4-yl)phenyl]methoxy]-4-thiophen-3-yl-naphthalene-2-carbonitrile

Systemtic Name: 3-[[3-(2-oxidanyloxan-4-yl)phenyl]methoxy]-4-thiophen-3-yl-naphthalene-2-carbonitrile Openeye Name: 3-[[3-(2-hydroxytetrahydropyran-4-yl)phenyl]methoxy]-4-(3-thienyl)naphthalene-2-carbonitrile CAS Name: 3-[[3-(2-hydroxy-4-oxanyl)phenyl]methoxy]-4-(3-thiophenyl)-2-naphthalenecarbonitrile IUPAC Name: 3-[[3-(2-hydroxyoxan-4-yl)phenyl]methoxy]-4-thiophen-3-ylnaphthalene-2-carbonitrile Traditional Name: 3-[3-(2-hydroxytetrahydropyran-4-yl)benzyl]oxy-4-(3-thienyl)naphthalene-2-carbonitrile Formula: C27H23NO3S MolecularWeight: 441.54142

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(CC1C2=CC(=CC=C2)COC3=C(C4=CC=CC=C4C=C3C#N)C5=CSC=C5)O

Isomeric SMILES

C1COC(CC1C2=CC(=CC=C2)COC3=C(C4=CC=CC=C4C=C3C#N)C5=CSC=C5)O

InChI

InChI=1S/C27H23NO3S/c28-15-23-13-21-5-1-2-7-24(21)26(22-9-11-32-17-22)27(23)31-16-18-4-3-6-19(12-18)20-8-10-30-25(29)14-20/h1-7,9,11-13,17,20,25,29H,8,10,14,16H2