(E)-but-2-enedioic acid; 2-[(Z)-[1-(4-chlorophenyl)-5-ethoxy-pentylidene]amino]oxyethanamine

Systemtic Name: (E)-but-2-enedioic acid; 2-[(Z)-[1-(4-chlorophenyl)-5-ethoxy-pentylidene]amino]oxyethanamine Openeye Name: 2-[(Z)-[1-(4-chlorophenyl)-5-ethoxy-pentylidene]amino]oxyethanamine; fumaric acid CAS Name: (E)-2-butenedioic acid; 2-[(Z)-[1-(4-chlorophenyl)-5-ethoxypentylidene]amino]oxyethanamine IUPAC Name: (E)-but-2-enedioic acid; 2-[(Z)-[1-(4-chlorophenyl)-5-ethoxypentylidene]amino]oxyethanamine Traditional Name: 2-[(Z)-[1-(4-chlorophenyl)-5-ethoxy-pentylidene]amino]oxyethylamine; fumaric acid Formula: C19H27ClN2O6 MolecularWeight: 414.88048

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCCC(=NOCCN)C1=CC=C(C=C1)Cl.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCOCCCC/C(=N/OCCN)/C1=CC=C(C=C1)Cl.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C15H23ClN2O2.C4H4O4/c1-2-19-11-4-3-5-15(18-20-12-10-17)13-6-8-14(16)9-7-13;5-3(6)1-2-4(7)8/h6-9H,2-5,10-12,17H2,1H3;1-2H,(H,5,6)(H,7,8)/b18-15-;2-1+