1-bromanyl-2-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-4-(2-methylphenyl)-1,2,3,4-tetrazolidine-5-carboxamide

Systemtic Name: 1-bromanyl-2-[3-(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)propoxy]-4-(2-methylphenyl)-1,2,3,4-tetrazolidine-5-carboxamide Openeye Name: 2-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-1-bromo-4-(o-tolyl)tetrazolidine-5-carboxamide CAS Name: 2-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-1-bromo-4-(2-methylphenyl)-5-tetrazolidinecarboxamide IUPAC Name: 2-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]-1-bromo-4-(2-methylphenyl)tetrazolidine-5-carboxamide Traditional Name: 2-[3-(4-acetyl-3-hydroxy-2-propyl-phenoxy)propoxy]-1-bromo-4-(o-tolyl)tetrazolidine-5-carboxamide Formula: C23H30BrN5O5 MolecularWeight: 536.4188

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCON2NN(C(N2Br)C(=O)N)C3=CC=CC=C3C

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCCCON2NN(C(N2Br)C(=O)N)C3=CC=CC=C3C

InChI

InChI=1S/C23H30BrN5O5/c1-4-8-18-20(12-11-17(16(3)30)21(18)31)33-13-7-14-34-29-26-27(23(22(25)32)28(29)24)19-10-6-5-9-15(19)2/h5-6,9-12,23,26,31H,4,7-8,13-14H2,1-3H3,(H2,25,32)