diethyl 2-[(2,2-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-pentalen-1-yl)methylidene]propanedioate

Systemtic Name: diethyl 2-[(2,2-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-pentalen-1-yl)methylidene]propanedioate Openeye Name: diethyl 2-[(2,2-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-pentalen-1-yl)methylene]propanedioate CAS Name: 2-[(2,2-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-pentalen-1-yl)methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2,2-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-pentalen-1-yl)methylidene]propanedioate Traditional Name: 2-[(2,2-dimethyl-3-phenyl-4,5,6,6a-tetrahydro-3aH-pentalen-1-yl)methylene]malonic acid diethyl ester Formula: C24H30O4 MolecularWeight: 382.4926

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C[C]1C2CCCC2[C](C1(C)C)C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=C[C]1C2CCCC2[C](C1(C)C)C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C24H30O4/c1-5-27-22(25)19(23(26)28-6-2)15-20-17-13-10-14-18(17)21(24(20,3)4)16-11-8-7-9-12-16/h7-9,11-12,15,17-18H,5-6,10,13-14H2,1-4H3