4,5-dihydroimidazol-1-amine; (E)-4-oxidanylidene-4-[4-[(4-propan-2-ylphenyl)methyl]phenoxy]but-2-enoate

Systemtic Name: 4,5-dihydroimidazol-1-amine; (E)-4-oxidanylidene-4-[4-[(4-propan-2-ylphenyl)methyl]phenoxy]but-2-enoate Openeye Name: 4,5-dihydroimidazol-1-amine; (E)-4-[4-[(4-isopropylphenyl)methyl]phenoxy]-4-oxo-but-2-enoate CAS Name: 4,5-dihydroimidazol-1-amine; (E)-4-oxo-4-[4-[(4-propan-2-ylphenyl)methyl]phenoxy]-2-butenoate IUPAC Name: 4,5-dihydroimidazol-1-amine; (E)-4-oxo-4-[4-[(4-propan-2-ylphenyl)methyl]phenoxy]but-2-enoate Traditional Name: 2-imidazolin-1-ylamine; (E)-4-[4-(4-isopropylbenzyl)phenoxy]-4-keto-but-2-enoate Formula: C23H26N3O4- MolecularWeight: 408.47024

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20O4.C3H7N3/c1-14(2)17-7-3-15(4-8-17)13-16-5-9-18(10-6-16)24-20(23)12-11-19(21)22;4-6-2-1-5-3-6/h3-12,14H,13H2,1-2H3,(H,21,22);3H,1-2,4H2/p-1/b12-11+;