N-[2-[4-(2-bromanyl-5-methoxy-phenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-4-phenylmethoxy-benzamide

Systemtic Name: N-[2-[4-(2-bromanyl-5-methoxy-phenyl)carbonylpiperazin-1-yl]-2-oxidanylidene-ethyl]-4-phenylmethoxy-benzamide Openeye Name: 4-benzyloxy-N-[2-[4-(2-bromo-5-methoxy-benzoyl)piperazin-1-yl]-2-oxo-ethyl]benzamide CAS Name: N-[2-[4-[(2-bromo-5-methoxyphenyl)-oxomethyl]-1-piperazinyl]-2-oxoethyl]-4-phenylmethoxybenzamide IUPAC Name: N-[2-[4-(2-bromo-5-methoxybenzoyl)piperazin-1-yl]-2-oxoethyl]-4-phenylmethoxybenzamide Traditional Name: 4-benzoxy-N-[2-[4-(2-bromo-5-methoxy-benzoyl)piperazino]-2-keto-ethyl]benzamide Formula: C28H28BrN3O5 MolecularWeight: 566.44302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)C(=O)N2CCN(CC2)C(=O)CNC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=CC(=C(C=C1)Br)C(=O)N2CCN(CC2)C(=O)CNC(=O)C3=CC=C(C=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C28H28BrN3O5/c1-36-23-11-12-25(29)24(17-23)28(35)32-15-13-31(14-16-32)26(33)18-30-27(34)21-7-9-22(10-8-21)37-19-20-5-3-2-4-6-20/h2-12,17H,13-16,18-19H2,1H3,(H,30,34)