[2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 4-pentoxybenzoate

Systemtic Name: [2-oxidanylidene-2-(1H-pyrrol-2-yl)ethyl] 4-pentoxybenzoate Openeye Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 4-pentoxybenzoate CAS Name: 4-pentoxybenzoic acid [2-oxo-2-(1H-pyrrol-2-yl)ethyl] ester IUPAC Name: [2-oxo-2-(1H-pyrrol-2-yl)ethyl] 4-pentoxybenzoate Traditional Name: 4-amoxybenzoic acid [2-keto-2-(1H-pyrrol-2-yl)ethyl] ester Formula: C18H21NO4 MolecularWeight: 315.36364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=CN2

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)OCC(=O)C2=CC=CN2

InChI

InChI=1S/C18H21NO4/c1-2-3-4-12-22-15-9-7-14(8-10-15)18(21)23-13-17(20)16-6-5-11-19-16/h5-11,19H,2-4,12-13H2,1H3