(E)-but-2-enedioic acid; 4-[(4-methoxyphenyl)-phenyl-methoxy]piperidine

Systemtic Name: (E)-but-2-enedioic acid; 4-[(4-methoxyphenyl)-phenyl-methoxy]piperidine Openeye Name: fumaric acid; 4-[(4-methoxyphenyl)-phenyl-methoxy]piperidine CAS Name: (E)-2-butenedioic acid; 4-[(4-methoxyphenyl)-phenylmethoxy]piperidine IUPAC Name: (E)-but-2-enedioic acid; 4-[(4-methoxyphenyl)-phenylmethoxy]piperidine Traditional Name: fumaric acid; 4-[(4-methoxyphenyl)-phenyl-methoxy]piperidine Formula: C23H27NO6 MolecularWeight: 413.46358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)OC3CCNCC3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C(C2=CC=CC=C2)OC3CCNCC3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C19H23NO2.C4H4O4/c1-21-17-9-7-16(8-10-17)19(15-5-3-2-4-6-15)22-18-11-13-20-14-12-18;5-3(6)1-2-4(7)8/h2-10,18-20H,11-14H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+