ethyl 2-cyano-5-(1,3-dioxolan-2-yl)-3-(4-methoxy-3-methyl-phenyl)-3-methyl-pentanoate

Systemtic Name: ethyl 2-cyano-5-(1,3-dioxolan-2-yl)-3-(4-methoxy-3-methyl-phenyl)-3-methyl-pentanoate Openeye Name: ethyl 2-cyano-5-(1,3-dioxolan-2-yl)-3-(4-methoxy-3-methyl-phenyl)-3-methyl-pentanoate CAS Name: 2-cyano-5-(1,3-dioxolan-2-yl)-3-(4-methoxy-3-methylphenyl)-3-methylpentanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-5-(1,3-dioxolan-2-yl)-3-(4-methoxy-3-methylphenyl)-3-methylpentanoate Traditional Name: 2-cyano-5-(1,3-dioxolan-2-yl)-3-(4-methoxy-3-methyl-phenyl)-3-methyl-valeric acid ethyl ester Formula: C20H27NO5 MolecularWeight: 361.43208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C(C)(CCC1OCCO1)C2=CC(=C(C=C2)OC)C

Isomeric SMILES

CCOC(=O)C(C#N)C(C)(CCC1OCCO1)C2=CC(=C(C=C2)OC)C

InChI

InChI=1S/C20H27NO5/c1-5-24-19(22)16(13-21)20(3,9-8-18-25-10-11-26-18)15-6-7-17(23-4)14(2)12-15/h6-7,12,16,18H,5,8-11H2,1-4H3