1-(3-azidophenoxy)-3-(propan-2-ylamino)propan-2-ol; (E)-but-2-enedioic acid

Systemtic Name: 1-(3-azidophenoxy)-3-(propan-2-ylamino)propan-2-ol; (E)-but-2-enedioic acid Openeye Name: 1-(3-azidophenoxy)-3-(isopropylamino)propan-2-ol; fumaric acid CAS Name: 1-(3-azidophenoxy)-3-(propan-2-ylamino)-2-propanol; (E)-2-butenedioic acid IUPAC Name: 1-(3-azidophenoxy)-3-(propan-2-ylamino)propan-2-ol; (E)-but-2-enedioic acid Traditional Name: 1-(3-azidophenoxy)-3-(isopropylamino)propan-2-ol; fumaric acid Formula: C16H22N4O6 MolecularWeight: 366.36908

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=CC(=C1)N=[N+]=[N-])O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)NCC(COC1=CC=CC(=C1)N=[N+]=[N-])O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C12H18N4O2.C4H4O4/c1-9(2)14-7-11(17)8-18-12-5-3-4-10(6-12)15-16-13;5-3(6)1-2-4(7)8/h3-6,9,11,14,17H,7-8H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+