tert-butyl 4-[1-(2-cyano-3-methoxy-cyclopent-2-en-1-yl)pentan-3-yl]benzoate

Systemtic Name: tert-butyl 4-[1-(2-cyano-3-methoxy-cyclopent-2-en-1-yl)pentan-3-yl]benzoate Openeye Name: tert-butyl 4-[3-(2-cyano-3-methoxy-cyclopent-2-en-1-yl)-1-ethyl-propyl]benzoate CAS Name: 4-[1-(2-cyano-3-methoxy-1-cyclopent-2-enyl)pentan-3-yl]benzoic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(2-cyano-3-methoxycyclopent-2-en-1-yl)pentan-3-yl]benzoate Traditional Name: 4-[3-(2-cyano-3-methoxy-cyclopent-2-en-1-yl)-1-ethyl-propyl]benzoic acid tert-butyl ester Formula: C23H31NO3 MolecularWeight: 369.49714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC1CCC(=C1C#N)OC)C2=CC=C(C=C2)C(=O)OC(C)(C)C

Isomeric SMILES

CCC(CCC1CCC(=C1C#N)OC)C2=CC=C(C=C2)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H31NO3/c1-6-16(7-10-18-13-14-21(26-5)20(18)15-24)17-8-11-19(12-9-17)22(25)27-23(2,3)4/h8-9,11-12,16,18H,6-7,10,13-14H2,1-5H3