2-[4-[(4-butoxyphenyl)methyl]phenoxy]-2-oxidanylidene-ethanoate; 4,5-dihydroimidazol-1-amine

Systemtic Name: 2-[4-[(4-butoxyphenyl)methyl]phenoxy]-2-oxidanylidene-ethanoate; 4,5-dihydroimidazol-1-amine Openeye Name: 2-[4-[(4-butoxyphenyl)methyl]phenoxy]-2-oxo-acetate; 4,5-dihydroimidazol-1-amine CAS Name: 2-[4-[(4-butoxyphenyl)methyl]phenoxy]-2-oxoacetate; 4,5-dihydroimidazol-1-amine IUPAC Name: 2-[4-[(4-butoxyphenyl)methyl]phenoxy]-2-oxoacetate; 4,5-dihydroimidazol-1-amine Traditional Name: 2-[4-(4-butoxybenzyl)phenoxy]-2-keto-acetate; 2-imidazolin-1-ylamine Formula: C22H26N3O5- MolecularWeight: 412.45894

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)CC2=CC=C(C=C2)OC(=O)C(=O)[O-].C1CN(C=N1)N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)CC2=CC=C(C=C2)OC(=O)C(=O)[O-].C1CN(C=N1)N

InChI

InChI=1S/C19H20O5.C3H7N3/c1-2-3-12-23-16-8-4-14(5-9-16)13-15-6-10-17(11-7-15)24-19(22)18(20)21;4-6-2-1-5-3-6/h4-11H,2-3,12-13H2,1H3,(H,20,21);3H,1-2,4H2/p-1