ethanedioic acid; 1-[3-(2-methoxy-4-prop-2-enyl-phenoxy)propyl]-4-(phenylmethyl)piperazine

Systemtic Name: ethanedioic acid; 1-[3-(2-methoxy-4-prop-2-enyl-phenoxy)propyl]-4-(phenylmethyl)piperazine Openeye Name: 1-[3-(4-allyl-2-methoxy-phenoxy)propyl]-4-benzyl-piperazine; oxalic acid CAS Name: 1-[3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-4-(phenylmethyl)piperazine; oxalic acid IUPAC Name: 1-benzyl-4-[3-(2-methoxy-4-prop-2-enylphenoxy)propyl]piperazine; oxalic acid Traditional Name: 1-[3-(4-allyl-2-methoxy-phenoxy)propyl]-4-benzyl-piperazine; oxalic acid Formula: C26H34N2O6 MolecularWeight: 470.55796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCCCN2CCN(CC2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCCCN2CCN(CC2)CC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H32N2O2.C2H2O4/c1-3-8-21-11-12-23(24(19-21)27-2)28-18-7-13-25-14-16-26(17-15-25)20-22-9-5-4-6-10-22;3-1(4)2(5)6/h3-6,9-12,19H,1,7-8,13-18,20H2,2H3;(H,3,4)(H,5,6)