ethyl 3-[2-(furan-2-ylmethylcarbamoyl)-4-(phenylmethyl)piperazin-1-yl]-3-oxidanylidene-propanoate

Systemtic Name: ethyl 3-[2-(furan-2-ylmethylcarbamoyl)-4-(phenylmethyl)piperazin-1-yl]-3-oxidanylidene-propanoate Openeye Name: ethyl 3-[4-benzyl-2-(2-furylmethylcarbamoyl)piperazin-1-yl]-3-oxo-propanoate CAS Name: 3-[2-[(2-furanylmethylamino)-oxomethyl]-4-(phenylmethyl)-1-piperazinyl]-3-oxopropanoic acid ethyl ester IUPAC Name: ethyl 3-[4-benzyl-2-(furan-2-ylmethylcarbamoyl)piperazin-1-yl]-3-oxopropanoate Traditional Name: 3-[4-benzyl-2-(2-furfurylcarbamoyl)piperazino]-3-keto-propionic acid ethyl ester Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)N1CCN(CC1C(=O)NCC2=CC=CO2)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CC(=O)N1CCN(CC1C(=O)NCC2=CC=CO2)CC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O5/c1-2-29-21(27)13-20(26)25-11-10-24(15-17-7-4-3-5-8-17)16-19(25)22(28)23-14-18-9-6-12-30-18/h3-9,12,19H,2,10-11,13-16H2,1H3,(H,23,28)