[2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl] 2-(3,4-dipropoxyphenyl)carbonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(oxolan-2-ylmethylamino)ethyl] 2-(3,4-dipropoxyphenyl)carbonylbenzoate Openeye Name: [2-oxo-2-(tetrahydrofuran-2-ylmethylamino)ethyl] 2-(3,4-dipropoxybenzoyl)benzoate CAS Name: 2-[(3,4-dipropoxyphenyl)-oxomethyl]benzoic acid [2-oxo-2-(2-oxolanylmethylamino)ethyl] ester IUPAC Name: [2-oxo-2-(oxolan-2-ylmethylamino)ethyl] 2-(3,4-dipropoxybenzoyl)benzoate Traditional Name: 2-(3,4-dipropoxybenzoyl)benzoic acid [2-keto-2-(tetrahydrofurfurylamino)ethyl] ester Formula: C27H33NO7 MolecularWeight: 483.55342

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC(=O)NCC3CCCO3)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)OCC(=O)NCC3CCCO3)OCCC

InChI

InChI=1S/C27H33NO7/c1-3-13-33-23-12-11-19(16-24(23)34-14-4-2)26(30)21-9-5-6-10-22(21)27(31)35-18-25(29)28-17-20-8-7-15-32-20/h5-6,9-12,16,20H,3-4,7-8,13-15,17-18H2,1-2H3,(H,28,29)