4-[8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-4-oxidanylidene-chromen-2-yl]benzenecarbonitrile

Systemtic Name: 4-[8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-4-oxidanylidene-chromen-2-yl]benzenecarbonitrile Openeye Name: 4-[8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-4-oxo-chromen-2-yl]benzonitrile CAS Name: 4-[8-[2-(hydroxymethyl)-1-methyl-3-pyrrolidinyl]-5,7-dimethoxy-4-oxo-1-benzopyran-2-yl]benzonitrile IUPAC Name: 4-[8-[2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]-5,7-dimethoxy-4-oxochromen-2-yl]benzonitrile Traditional Name: 4-[4-keto-5,7-dimethoxy-8-(1-methyl-2-methylol-pyrrolidin-3-yl)chromen-2-yl]benzonitrile Formula: C24H24N2O5 MolecularWeight: 420.45776

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C1CO)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC=C(C=C4)C#N)OC)OC

Isomeric SMILES

CN1CCC(C1CO)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC=C(C=C4)C#N)OC)OC

InChI

InChI=1S/C24H24N2O5/c1-26-9-8-16(17(26)13-27)22-20(29-2)11-21(30-3)23-18(28)10-19(31-24(22)23)15-6-4-14(12-25)5-7-15/h4-7,10-11,16-17,27H,8-9,13H2,1-3H3