ethyl 2-[4-(furan-2-ylcarbonyl)-3-[(phenylmethyl)carbamoyl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-(furan-2-ylcarbonyl)-3-[(phenylmethyl)carbamoyl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[3-(benzylcarbamoyl)-4-(furan-2-carbonyl)piperazin-1-yl]acetate CAS Name: 2-[4-[2-furanyl(oxo)methyl]-3-[oxo-[(phenylmethyl)amino]methyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-(benzylcarbamoyl)-4-(furan-2-carbonyl)piperazin-1-yl]acetate Traditional Name: 2-[3-(benzylcarbamoyl)-4-(2-furoyl)piperazino]acetic acid ethyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(C(C1)C(=O)NCC2=CC=CC=C2)C(=O)C3=CC=CO3

Isomeric SMILES

CCOC(=O)CN1CCN(C(C1)C(=O)NCC2=CC=CC=C2)C(=O)C3=CC=CO3

InChI

InChI=1S/C21H25N3O5/c1-2-28-19(25)15-23-10-11-24(21(27)18-9-6-12-29-18)17(14-23)20(26)22-13-16-7-4-3-5-8-16/h3-9,12,17H,2,10-11,13-15H2,1H3,(H,22,26)