N-[4-[[(3-bromanyl-4-hexoxy-phenyl)carbonylamino]carbamoyl]phenyl]cyclohexanecarboxamide

Systemtic Name: N-[4-[[(3-bromanyl-4-hexoxy-phenyl)carbonylamino]carbamoyl]phenyl]cyclohexanecarboxamide Openeye Name: N-[4-[[(3-bromo-4-hexoxy-benzoyl)amino]carbamoyl]phenyl]cyclohexanecarboxamide CAS Name: N-[4-[[[(3-bromo-4-hexoxyphenyl)-oxomethyl]hydrazo]-oxomethyl]phenyl]cyclohexanecarboxamide IUPAC Name: N-[4-[[(3-bromo-4-hexoxybenzoyl)amino]carbamoyl]phenyl]cyclohexanecarboxamide Traditional Name: N-[4-[[(3-bromo-4-hexoxy-benzoyl)amino]carbamoyl]phenyl]cyclohexanecarboxamide Formula: C27H34BrN3O4 MolecularWeight: 544.48056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NNC(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3)Br

InChI

InChI=1S/C27H34BrN3O4/c1-2-3-4-8-17-35-24-16-13-21(18-23(24)28)27(34)31-30-26(33)20-11-14-22(15-12-20)29-25(32)19-9-6-5-7-10-19/h11-16,18-19H,2-10,17H2,1H3,(H,29,32)(H,30,33)(H,31,34)