(E)-but-2-enedioic acid; N,N-dimethyl-4-(piperidin-3-ylmethyl)aniline

Systemtic Name: (E)-but-2-enedioic acid; N,N-dimethyl-4-(piperidin-3-ylmethyl)aniline Openeye Name: N,N-dimethyl-4-(3-piperidylmethyl)aniline; fumaric acid CAS Name: (E)-2-butenedioic acid; N,N-dimethyl-4-(3-piperidinylmethyl)aniline IUPAC Name: (E)-but-2-enedioic acid; N,N-dimethyl-4-(piperidin-3-ylmethyl)aniline Traditional Name: dimethyl-[4-(3-piperidylmethyl)phenyl]amine; fumaric acid Formula: C18H26N2O4 MolecularWeight: 334.41004

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CC2CCCNC2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CC2CCCNC2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H22N2.C4H4O4/c1-16(2)14-7-5-12(6-8-14)10-13-4-3-9-15-11-13;5-3(6)1-2-4(7)8/h5-8,13,15H,3-4,9-11H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+