ethanedioic acid; 3-[(2-methoxy-4-prop-2-enyl-phenoxy)methyl]-4-phenyl-piperidine

Systemtic Name: ethanedioic acid; 3-[(2-methoxy-4-prop-2-enyl-phenoxy)methyl]-4-phenyl-piperidine Openeye Name: 3-[(4-allyl-2-methoxy-phenoxy)methyl]-4-phenyl-piperidine; oxalic acid CAS Name: 3-[(2-methoxy-4-prop-2-enylphenoxy)methyl]-4-phenylpiperidine; oxalic acid IUPAC Name: 3-[(2-methoxy-4-prop-2-enylphenoxy)methyl]-4-phenylpiperidine; oxalic acid Traditional Name: 3-[(4-allyl-2-methoxy-phenoxy)methyl]-4-phenyl-piperidine; oxalic acid Formula: C24H29NO6 MolecularWeight: 427.49016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CC=C)OCC2CNCCC2C3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CC=C)OCC2CNCCC2C3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H27NO2.C2H2O4/c1-3-7-17-10-11-21(22(14-17)24-2)25-16-19-15-23-13-12-20(19)18-8-5-4-6-9-18;3-1(4)2(5)6/h3-6,8-11,14,19-20,23H,1,7,12-13,15-16H2,2H3;(H,3,4)(H,5,6)