propyl 2-(2-cyanoethyl)-2-(3-propoxyphenyl)cyclopentane-1-carboxylate

Systemtic Name: propyl 2-(2-cyanoethyl)-2-(3-propoxyphenyl)cyclopentane-1-carboxylate Openeye Name: propyl 2-(2-cyanoethyl)-2-(3-propoxyphenyl)cyclopentanecarboxylate CAS Name: 2-(2-cyanoethyl)-2-(3-propoxyphenyl)-1-cyclopentanecarboxylic acid propyl ester IUPAC Name: propyl 2-(2-cyanoethyl)-2-(3-propoxyphenyl)cyclopentane-1-carboxylate Traditional Name: 2-(2-cyanoethyl)-2-(3-propoxyphenyl)cyclopentanecarboxylic acid propyl ester Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C2(CCCC2C(=O)OCCC)CCC#N

Isomeric SMILES

CCCOC1=CC=CC(=C1)C2(CCCC2C(=O)OCCC)CCC#N

InChI

InChI=1S/C21H29NO3/c1-3-14-24-18-9-5-8-17(16-18)21(12-7-13-22)11-6-10-19(21)20(23)25-15-4-2/h5,8-9,16,19H,3-4,6-7,10-12,14-15H2,1-2H3