diethyl 3-methylidene-4-(2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)cyclopentane-1,1-dicarboxylate

Systemtic Name: diethyl 3-methylidene-4-(2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)cyclopentane-1,1-dicarboxylate Openeye Name: diethyl 3-methylene-4-(2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)cyclopentane-1,1-dicarboxylate CAS Name: 3-methylene-4-(2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)cyclopentane-1,1-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-methylidene-4-(2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)cyclopentane-1,1-dicarboxylate Traditional Name: 3-methylene-4-(2-phenyl-4,5,6,7-tetrahydroisoindol-1-yl)cyclopentane-1,1-dicarboxylic acid diethyl ester Formula: C26H31NO4 MolecularWeight: 421.52864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC(C(=C)C1)C2=C3CCCCC3=CN2C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1(CC(C(=C)C1)C2=C3CCCCC3=CN2C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C26H31NO4/c1-4-30-24(28)26(25(29)31-5-2)15-18(3)22(16-26)23-21-14-10-9-11-19(21)17-27(23)20-12-7-6-8-13-20/h6-8,12-13,17,22H,3-5,9-11,14-16H2,1-2H3