ethyl 4-[2,5-bis(oxidanylidene)-3-(4-phenylpiperazin-1-yl)pyrrol-1-yl]benzoate

Systemtic Name: ethyl 4-[2,5-bis(oxidanylidene)-3-(4-phenylpiperazin-1-yl)pyrrol-1-yl]benzoate Openeye Name: ethyl 4-[2,5-dioxo-3-(4-phenylpiperazin-1-yl)pyrrol-1-yl]benzoate CAS Name: 4-[2,5-dioxo-3-(4-phenyl-1-piperazinyl)-1-pyrrolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2,5-dioxo-3-(4-phenylpiperazin-1-yl)pyrrol-1-yl]benzoate Traditional Name: 4-[2,5-diketo-3-(4-phenylpiperazino)-3-pyrrolin-1-yl]benzoic acid ethyl ester Formula: C23H23N3O4 MolecularWeight: 405.44642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C=C(C2=O)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C=C(C2=O)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3O4/c1-2-30-23(29)17-8-10-19(11-9-17)26-21(27)16-20(22(26)28)25-14-12-24(13-15-25)18-6-4-3-5-7-18/h3-11,16H,2,12-15H2,1H3