[2-[2-(4-chloranylphenoxy)ethylamino]-2-oxidanylidene-ethyl] 4-pyrrol-1-ylbenzoate

Systemtic Name: [2-[2-(4-chloranylphenoxy)ethylamino]-2-oxidanylidene-ethyl] 4-pyrrol-1-ylbenzoate Openeye Name: [2-[2-(4-chlorophenoxy)ethylamino]-2-oxo-ethyl] 4-pyrrol-1-ylbenzoate CAS Name: 4-(1-pyrrolyl)benzoic acid [2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-chlorophenoxy)ethylamino]-2-oxoethyl] 4-pyrrol-1-ylbenzoate Traditional Name: 4-pyrrol-1-ylbenzoic acid [2-[2-(4-chlorophenoxy)ethylamino]-2-keto-ethyl] ester Formula: C21H19ClN2O4 MolecularWeight: 398.83956

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC=C(C=C2)C(=O)OCC(=O)NCCOC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CN(C=C1)C2=CC=C(C=C2)C(=O)OCC(=O)NCCOC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H19ClN2O4/c22-17-5-9-19(10-6-17)27-14-11-23-20(25)15-28-21(26)16-3-7-18(8-4-16)24-12-1-2-13-24/h1-10,12-13H,11,14-15H2,(H,23,25)