methyl 5-(furan-2-yl)-1-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]pyrrole-2-carboxylate

Systemtic Name: methyl 5-(furan-2-yl)-1-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]ethyl]pyrrole-2-carboxylate Openeye Name: methyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxo-ethyl]-5-(2-furyl)pyrrole-2-carboxylate CAS Name: 5-(2-furanyl)-1-[2-oxo-2-[4-(phenylmethyl)-1-piperazinyl]ethyl]-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5-(furan-2-yl)pyrrole-2-carboxylate Traditional Name: 1-[2-(4-benzylpiperazino)-2-keto-ethyl]-5-(2-furyl)pyrrole-2-carboxylic acid methyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(N1CC(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

COC(=O)C1=CC=C(N1CC(=O)N2CCN(CC2)CC3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C23H25N3O4/c1-29-23(28)20-10-9-19(21-8-5-15-30-21)26(20)17-22(27)25-13-11-24(12-14-25)16-18-6-3-2-4-7-18/h2-10,15H,11-14,16-17H2,1H3