ethanedioic acid; furan-2-yl-[4-(3-phenylpropyl)piperazin-1-yl]methanone

Systemtic Name: ethanedioic acid; furan-2-yl-[4-(3-phenylpropyl)piperazin-1-yl]methanone Openeye Name: 2-furyl-[4-(3-phenylpropyl)piperazin-1-yl]methanone; oxalic acid CAS Name: 2-furanyl-[4-(3-phenylpropyl)-1-piperazinyl]methanone; oxalic acid IUPAC Name: furan-2-yl-[4-(3-phenylpropyl)piperazin-1-yl]methanone; oxalic acid Traditional Name: 2-furyl-[4-(3-phenylpropyl)piperazino]methanone; oxalic acid Formula: C20H24N2O6 MolecularWeight: 388.41436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC=CC=C2)C(=O)C3=CC=CO3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CCCC2=CC=CC=C2)C(=O)C3=CC=CO3.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H22N2O2.C2H2O4/c21-18(17-9-5-15-22-17)20-13-11-19(12-14-20)10-4-8-16-6-2-1-3-7-16;3-1(4)2(5)6/h1-3,5-7,9,15H,4,8,10-14H2;(H,3,4)(H,5,6)