diethyl 2,6-diisocyano-1,3,5,7-tetrahydro-s-indacene-2,6-dicarboxylate

Systemtic Name: diethyl 2,6-diisocyano-1,3,5,7-tetrahydro-s-indacene-2,6-dicarboxylate Openeye Name: diethyl 2,6-diisocyano-1,3,5,7-tetrahydro-s-indacene-2,6-dicarboxylate CAS Name: 2,6-diisocyano-1,3,5,7-tetrahydro-s-indacene-2,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2,6-diisocyano-1,3,5,7-tetrahydro-s-indacene-2,6-dicarboxylate Traditional Name: 2,6-diisocyano-1,3,5,7-tetrahydro-s-indacene-2,6-dicarboxylic acid diethyl ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC2=CC3=C(CC(C3)(C(=O)OCC)[N+]#[C-])C=C2C1)[N+]#[C-]

Isomeric SMILES

CCOC(=O)C1(CC2=CC3=C(CC(C3)(C(=O)OCC)[N+]#[C-])C=C2C1)[N+]#[C-]

InChI

InChI=1S/C20H20N2O4/c1-5-25-17(23)19(21-3)9-13-7-15-11-20(22-4,18(24)26-6-2)12-16(15)8-14(13)10-19/h7-8H,5-6,9-12H2,1-2H3