dimethyl (2S,4S)-2-cyano-4-(4-methoxyphenyl)cyclobutane-1,1-dicarboxylate

Systemtic Name: dimethyl (2S,4S)-2-cyano-4-(4-methoxyphenyl)cyclobutane-1,1-dicarboxylate Openeye Name: dimethyl (2S,4S)-2-cyano-4-(4-methoxyphenyl)cyclobutane-1,1-dicarboxylate CAS Name: (2S,4S)-2-cyano-4-(4-methoxyphenyl)cyclobutane-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,4S)-2-cyano-4-(4-methoxyphenyl)cyclobutane-1,1-dicarboxylate Traditional Name: (2S,4S)-2-cyano-4-(4-methoxyphenyl)cyclobutane-1,1-dicarboxylic acid dimethyl ester Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(C2(C(=O)OC)C(=O)OC)C#N

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2C[C@@H](C2(C(=O)OC)C(=O)OC)C#N

InChI

InChI=1S/C16H17NO5/c1-20-12-6-4-10(5-7-12)13-8-11(9-17)16(13,14(18)21-2)15(19)22-3/h4-7,11,13H,8H2,1-3H3/t11-,13+/m1/s1