N-[4-[(4-butan-2-yloxyphenyl)methyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine; (E)-but-2-enedioic acid

Systemtic Name: N-[4-[(4-butan-2-yloxyphenyl)methyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine; (E)-but-2-enedioic acid Openeye Name: fumaric acid; N-[4-[(4-sec-butoxyphenyl)methyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine CAS Name: N-[4-[(4-butan-2-yloxyphenyl)methyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine; (E)-2-butenedioic acid IUPAC Name: N-[4-[(4-butan-2-yloxyphenyl)methyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine; (E)-but-2-enedioic acid Traditional Name: fumaric acid; 2-imidazolin-2-yl-[4-(4-sec-butoxybenzyl)phenyl]amine Formula: C24H29N3O5 MolecularWeight: 439.50416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)CC2=CC=C(C=C2)NC3=NCCN3.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)CC2=CC=C(C=C2)NC3=NCCN3.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C20H25N3O.C4H4O4/c1-3-15(2)24-19-10-6-17(7-11-19)14-16-4-8-18(9-5-16)23-20-21-12-13-22-20;5-3(6)1-2-4(7)8/h4-11,15H,3,12-14H2,1-2H3,(H2,21,22,23);1-2H,(H,5,6)(H,7,8)/b;2-1+