(phenylmethyl) 4-(3-methoxy-3-oxidanylidene-propyl)-3-[2-(oxan-2-yloxy)ethyl]-1H-pyrrole-2-carboxylate

Systemtic Name: (phenylmethyl) 4-(3-methoxy-3-oxidanylidene-propyl)-3-[2-(oxan-2-yloxy)ethyl]-1H-pyrrole-2-carboxylate Openeye Name: benzyl 4-(3-methoxy-3-oxo-propyl)-3-(2-tetrahydropyran-2-yloxyethyl)-1H-pyrrole-2-carboxylate CAS Name: 4-(3-methoxy-3-oxopropyl)-3-[2-(2-oxanyloxy)ethyl]-1H-pyrrole-2-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(3-methoxy-3-oxopropyl)-3-[2-(oxan-2-yloxy)ethyl]-1H-pyrrole-2-carboxylate Traditional Name: 4-(3-keto-3-methoxy-propyl)-3-(2-tetrahydropyran-2-yloxyethyl)-1H-pyrrole-2-carboxylic acid benzyl ester Formula: C23H29NO6 MolecularWeight: 415.47946

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1=CNC(=C1CCOC2CCCCO2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CCC1=CNC(=C1CCOC2CCCCO2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H29NO6/c1-27-20(25)11-10-18-15-24-22(23(26)30-16-17-7-3-2-4-8-17)19(18)12-14-29-21-9-5-6-13-28-21/h2-4,7-8,15,21,24H,5-6,9-14,16H2,1H3