[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-methoxy-4-(2-methylpropoxy)benzoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 3-methoxy-4-(2-methylpropoxy)benzoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 4-isobutoxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-(2-methylpropoxy)benzoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 3-methoxy-4-(2-methylpropoxy)benzoate Traditional Name: 4-isobutoxy-3-methoxy-benzoic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC=CN2)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)OCC(=O)C2=CC=CN2)OC

InChI

InChI=1S/C18H21NO5/c1-12(2)10-23-16-7-6-13(9-17(16)22-3)18(21)24-11-15(20)14-5-4-8-19-14/h4-9,12,19H,10-11H2,1-3H3