[(3E)-3-(1-cyano-3,3-dimethyl-2-oxidanylidene-butylidene)-6-methoxy-1,1-dimethyl-2H-inden-5-yl] ethanoate

Systemtic Name: [(3E)-3-(1-cyano-3,3-dimethyl-2-oxidanylidene-butylidene)-6-methoxy-1,1-dimethyl-2H-inden-5-yl] ethanoate Openeye Name: [(3E)-3-(1-cyano-3,3-dimethyl-2-oxo-butylidene)-6-methoxy-1,1-dimethyl-indan-5-yl] acetate CAS Name: acetic acid [(3E)-3-(1-cyano-3,3-dimethyl-2-oxobutylidene)-6-methoxy-1,1-dimethyl-2H-inden-5-yl] ester IUPAC Name: [(3E)-3-(1-cyano-3,3-dimethyl-2-oxobutylidene)-6-methoxy-1,1-dimethyl-2H-inden-5-yl] acetate Traditional Name: acetic acid [(3E)-3-(1-cyano-2-keto-3,3-dimethyl-butylidene)-6-methoxy-1,1-dimethyl-indan-5-yl] ester Formula: C21H25NO4 MolecularWeight: 355.4275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C2C(=C1)C(=C(C#N)C(=O)C(C)(C)C)CC2(C)C)OC

Isomeric SMILES

CC(=O)OC1=C(C=C2C(=C1)/C(=C(\C#N)/C(=O)C(C)(C)C)/CC2(C)C)OC

InChI

InChI=1S/C21H25NO4/c1-12(23)26-18-8-13-14(15(11-22)19(24)20(2,3)4)10-21(5,6)16(13)9-17(18)25-7/h8-9H,10H2,1-7H3/b15-14+