cyanomethyl 2-(3,4-dipropoxyphenyl)carbonylbenzoate

Systemtic Name: cyanomethyl 2-(3,4-dipropoxyphenyl)carbonylbenzoate Openeye Name: cyanomethyl 2-(3,4-dipropoxybenzoyl)benzoate CAS Name: 2-[(3,4-dipropoxyphenyl)-oxomethyl]benzoic acid cyanomethyl ester IUPAC Name: cyanomethyl 2-(3,4-dipropoxybenzoyl)benzoate Traditional Name: 2-(3,4-dipropoxybenzoyl)benzoic acid cyanomethyl ester Formula: C22H23NO5 MolecularWeight: 381.42172

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC#N)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC#N)OCCC

InChI

InChI=1S/C22H23NO5/c1-3-12-26-19-10-9-16(15-20(19)27-13-4-2)21(24)17-7-5-6-8-18(17)22(25)28-14-11-23/h5-10,15H,3-4,12-14H2,1-2H3