[cyano-(3-phenylazanylphenyl)methyl] 2,2-dimethyl-3-pentoxy-cyclopropane-1-carboxylate

Systemtic Name: [cyano-(3-phenylazanylphenyl)methyl] 2,2-dimethyl-3-pentoxy-cyclopropane-1-carboxylate Openeye Name: [(3-anilinophenyl)-cyano-methyl] 2,2-dimethyl-3-pentoxy-cyclopropanecarboxylate CAS Name: 2,2-dimethyl-3-pentoxy-1-cyclopropanecarboxylic acid [(3-anilinophenyl)-cyanomethyl] ester IUPAC Name: [(3-anilinophenyl)-cyanomethyl] 2,2-dimethyl-3-pentoxycyclopropane-1-carboxylate Traditional Name: 3-amoxy-2,2-dimethyl-cyclopropanecarboxylic acid [(3-anilinophenyl)-cyano-methyl] ester Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1C(C1(C)C)C(=O)OC(C#N)C2=CC(=CC=C2)NC3=CC=CC=C3

Isomeric SMILES

CCCCCOC1C(C1(C)C)C(=O)OC(C#N)C2=CC(=CC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C25H30N2O3/c1-4-5-9-15-29-23-22(25(23,2)3)24(28)30-21(17-26)18-11-10-14-20(16-18)27-19-12-7-6-8-13-19/h6-8,10-14,16,21-23,27H,4-5,9,15H2,1-3H3