4-(3-azabicyclo[3.1.0]hexan-5-yl)-N-ethyl-aniline; (E)-but-2-enedioic acid

Systemtic Name: 4-(3-azabicyclo[3.1.0]hexan-5-yl)-N-ethyl-aniline; (E)-but-2-enedioic acid Openeye Name: 4-(3-azabicyclo[3.1.0]hexan-5-yl)-N-ethyl-aniline; fumaric acid CAS Name: 4-(3-azabicyclo[3.1.0]hexan-5-yl)-N-ethylaniline; (E)-2-butenedioic acid IUPAC Name: 4-(3-azabicyclo[3.1.0]hexan-5-yl)-N-ethylaniline; (E)-but-2-enedioic acid Traditional Name: [4-(3-azabicyclo[3.1.0]hexan-5-yl)phenyl]-ethyl-amine; fumaric acid Formula: C17H22N2O4 MolecularWeight: 318.36758

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=CC=C(C=C1)C23CC2CNC3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCNC1=CC=C(C=C1)C23CC2CNC3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C13H18N2.C4H4O4/c1-2-15-12-5-3-10(4-6-12)13-7-11(13)8-14-9-13;5-3(6)1-2-4(7)8/h3-6,11,14-15H,2,7-9H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+