methyl (3aR,3bS,9S,9aR)-9-cyano-3-propan-2-ylidene-3b,9a-dihydro-3aH-cyclopenta[a]azulene-9-carboxylate

Systemtic Name: methyl (3aR,3bS,9S,9aR)-9-cyano-3-propan-2-ylidene-3b,9a-dihydro-3aH-cyclopenta[a]azulene-9-carboxylate Openeye Name: methyl (3aR,3bS,9S,9aR)-9-cyano-3-isopropylidene-3b,9a-dihydro-3aH-cyclopenta[a]azulene-9-carboxylate CAS Name: (3aR,3bS,9S,9aR)-9-cyano-3-propan-2-ylidene-3b,9a-dihydro-3aH-cyclopenta[a]azulene-9-carboxylic acid methyl ester IUPAC Name: methyl (3aR,3bS,9S,9aR)-9-cyano-3-propan-2-ylidene-3b,9a-dihydro-3aH-cyclopenta[a]azulene-9-carboxylate Traditional Name: (3aR,3bS,9S,9aR)-9-cyano-3-isopropylidene-3b,9a-dihydro-3aH-cyclopent[a]azulene-9-carboxylic acid methyl ester Formula: C19H19NO2 MolecularWeight: 293.35966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC2C1C3C=CC=CC=C3C2(C#N)C(=O)OC)C

Isomeric SMILES

CC(=C1C=C[C@@H]2[C@H]1[C@@H]3C=CC=CC=C3[C@@]2(C#N)C(=O)OC)C

InChI

InChI=1S/C19H19NO2/c1-12(2)13-9-10-16-17(13)14-7-5-4-6-8-15(14)19(16,11-20)18(21)22-3/h4-10,14,16-17H,1-3H3/t14-,16-,17-,19-/m1/s1