ethanedioic acid; N-[4-[(4-pentoxyphenyl)methyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine

Systemtic Name: ethanedioic acid; N-[4-[(4-pentoxyphenyl)methyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine Openeye Name: oxalic acid; N-[4-[(4-pentoxyphenyl)methyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine CAS Name: oxalic acid; N-[4-[(4-pentoxyphenyl)methyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine IUPAC Name: oxalic acid; N-[4-[(4-pentoxyphenyl)methyl]phenyl]-4,5-dihydro-1H-imidazol-2-amine Traditional Name: [4-(4-amoxybenzyl)phenyl]-(2-imidazolin-2-yl)amine; oxalic acid Formula: C23H29N3O5 MolecularWeight: 427.49346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)CC2=CC=C(C=C2)NC3=NCCN3.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)CC2=CC=C(C=C2)NC3=NCCN3.C(=O)(C(=O)O)O

InChI

InChI=1S/C21H27N3O.C2H2O4/c1-2-3-4-15-25-20-11-7-18(8-12-20)16-17-5-9-19(10-6-17)24-21-22-13-14-23-21;3-1(4)2(5)6/h5-12H,2-4,13-16H2,1H3,(H2,22,23,24);(H,3,4)(H,5,6)