(3R,4S)-1-(4-methoxy-3-phenylmethoxy-phenyl)-3,4-bis(2-oxidanylideneethyl)cyclopentane-1-carbonitrile

Systemtic Name: (3R,4S)-1-(4-methoxy-3-phenylmethoxy-phenyl)-3,4-bis(2-oxidanylideneethyl)cyclopentane-1-carbonitrile Openeye Name: (3R,4S)-1-(3-benzyloxy-4-methoxy-phenyl)-3,4-bis(2-oxoethyl)cyclopentanecarbonitrile CAS Name: (3R,4S)-1-(4-methoxy-3-phenylmethoxyphenyl)-3,4-bis(2-oxoethyl)-1-cyclopentanecarbonitrile IUPAC Name: (3R,4S)-1-(4-methoxy-3-phenylmethoxyphenyl)-3,4-bis(2-oxoethyl)cyclopentane-1-carbonitrile Traditional Name: (3R,4S)-1-(3-benzoxy-4-methoxy-phenyl)-3,4-bis(2-ketoethyl)cyclopentanecarbonitrile Formula: C24H25NO4 MolecularWeight: 391.4596

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2(CC(C(C2)CC=O)CC=O)C#N)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)C2(C[C@@H]([C@@H](C2)CC=O)CC=O)C#N)OCC3=CC=CC=C3

InChI

InChI=1S/C24H25NO4/c1-28-22-8-7-21(13-23(22)29-16-18-5-3-2-4-6-18)24(17-25)14-19(9-11-26)20(15-24)10-12-27/h2-8,11-13,19-20H,9-10,14-16H2,1H3/t19-,20+,24?