methyl (2E)-2-(2-cyano-7-methoxy-2-methyl-9-oxidanylidene-4,4a,10,10a-tetrahydro-3H-phenanthren-1-ylidene)ethanoate

Systemtic Name: methyl (2E)-2-(2-cyano-7-methoxy-2-methyl-9-oxidanylidene-4,4a,10,10a-tetrahydro-3H-phenanthren-1-ylidene)ethanoate Openeye Name: methyl (2E)-2-(2-cyano-7-methoxy-2-methyl-9-oxo-4,4a,10,10a-tetrahydro-3H-phenanthren-1-ylidene)acetate CAS Name: (2E)-2-(2-cyano-7-methoxy-2-methyl-9-oxo-4,4a,10,10a-tetrahydro-3H-phenanthren-1-ylidene)acetic acid methyl ester IUPAC Name: methyl (2E)-2-(2-cyano-7-methoxy-2-methyl-9-oxo-4,4a,10,10a-tetrahydro-3H-phenanthren-1-ylidene)acetate Traditional Name: (2E)-2-(2-cyano-9-keto-7-methoxy-2-methyl-4,4a,10,10a-tetrahydro-3H-phenanthren-1-ylidene)acetic acid methyl ester Formula: C20H21NO4 MolecularWeight: 339.38504

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2C(C1=CC(=O)OC)CC(=O)C3=C2C=CC(=C3)OC)C#N

Isomeric SMILES

CC\1(CCC2C(/C1=C\C(=O)OC)CC(=O)C3=C2C=CC(=C3)OC)C#N

InChI

InChI=1S/C20H21NO4/c1-20(11-21)7-6-14-13-5-4-12(24-2)8-16(13)18(22)9-15(14)17(20)10-19(23)25-3/h4-5,8,10,14-15H,6-7,9H2,1-3H3/b17-10+