ethanedioic acid; 2-naphthalen-2-yloxy-1-[4-(3-phenylpropyl)piperazin-1-yl]ethanone

Systemtic Name: ethanedioic acid; 2-naphthalen-2-yloxy-1-[4-(3-phenylpropyl)piperazin-1-yl]ethanone Openeye Name: 2-(2-naphthyloxy)-1-[4-(3-phenylpropyl)piperazin-1-yl]ethanone; oxalic acid CAS Name: 2-(2-naphthalenyloxy)-1-[4-(3-phenylpropyl)-1-piperazinyl]ethanone; oxalic acid IUPAC Name: 2-naphthalen-2-yloxy-1-[4-(3-phenylpropyl)piperazin-1-yl]ethanone; oxalic acid Traditional Name: 2-(2-naphthoxy)-1-[4-(3-phenylpropyl)piperazino]ethanone; oxalic acid Formula: C27H30N2O6 MolecularWeight: 478.5369

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2=CC=CC=C2)C(=O)COC3=CC4=CC=CC=C4C=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1CCCC2=CC=CC=C2)C(=O)COC3=CC4=CC=CC=C4C=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C25H28N2O2.C2H2O4/c28-25(20-29-24-13-12-22-10-4-5-11-23(22)19-24)27-17-15-26(16-18-27)14-6-9-21-7-2-1-3-8-21;3-1(4)2(5)6/h1-5,7-8,10-13,19H,6,9,14-18,20H2;(H,3,4)(H,5,6)