(4-butoxy-2-cyano-3-isocyano-phenyl) 4-pentylcyclohexane-1-carboxylate

Systemtic Name: (4-butoxy-2-cyano-3-isocyano-phenyl) 4-pentylcyclohexane-1-carboxylate Openeye Name: (4-butoxy-2-cyano-3-isocyano-phenyl) 4-pentylcyclohexanecarboxylate CAS Name: 4-pentyl-1-cyclohexanecarboxylic acid (4-butoxy-2-cyano-3-isocyanophenyl) ester IUPAC Name: (4-butoxy-2-cyano-3-isocyanophenyl) 4-pentylcyclohexane-1-carboxylate Traditional Name: 4-amylcyclohexanecarboxylic acid (4-butoxy-2-cyano-3-isocyano-phenyl) ester Formula: C24H32N2O3 MolecularWeight: 396.52248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)OCCCC)[N+]#[C-])C#N

Isomeric SMILES

CCCCCC1CCC(CC1)C(=O)OC2=C(C(=C(C=C2)OCCCC)[N+]#[C-])C#N

InChI

InChI=1S/C24H32N2O3/c1-4-6-8-9-18-10-12-19(13-11-18)24(27)29-21-14-15-22(28-16-7-5-2)23(26-3)20(21)17-25/h14-15,18-19H,4-13,16H2,1-2H3