3-[(4R)-4-(3,4-dicyclopentyloxyphenyl)-2-oxidanylidene-pyrrolidin-1-yl]benzenecarbonitrile

Systemtic Name: 3-[(4R)-4-(3,4-dicyclopentyloxyphenyl)-2-oxidanylidene-pyrrolidin-1-yl]benzenecarbonitrile Openeye Name: 3-[(4R)-4-[3,4-bis(cyclopentoxy)phenyl]-2-oxo-pyrrolidin-1-yl]benzonitrile CAS Name: 3-[(4R)-4-(3,4-dicyclopentyloxyphenyl)-2-oxo-1-pyrrolidinyl]benzonitrile IUPAC Name: 3-[(4R)-4-(3,4-dicyclopentyloxyphenyl)-2-oxopyrrolidin-1-yl]benzonitrile Traditional Name: 3-[(4R)-4-[3,4-bis(cyclopentoxy)phenyl]-2-keto-pyrrolidino]benzonitrile Formula: C27H30N2O3 MolecularWeight: 430.5387

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=C(C=C(C=C2)C3CC(=O)N(C3)C4=CC=CC(=C4)C#N)OC5CCCC5

Isomeric SMILES

C1CCC(C1)OC2=C(C=C(C=C2)[C@H]3CC(=O)N(C3)C4=CC=CC(=C4)C#N)OC5CCCC5

InChI

InChI=1S/C27H30N2O3/c28-17-19-6-5-7-22(14-19)29-18-21(16-27(29)30)20-12-13-25(31-23-8-1-2-9-23)26(15-20)32-24-10-3-4-11-24/h5-7,12-15,21,23-24H,1-4,8-11,16,18H2/t21-/m0/s1