3-bromanyl-N-[3-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-4-ethoxy-benzamide

Systemtic Name: 3-bromanyl-N-[3-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]-4-ethoxy-benzamide Openeye Name: 3-bromo-N-[3-chloro-2-(4-methylpiperazin-1-yl)phenyl]-4-ethoxy-benzamide CAS Name: 3-bromo-N-[3-chloro-2-(4-methyl-1-piperazinyl)phenyl]-4-ethoxybenzamide IUPAC Name: 3-bromo-N-[3-chloro-2-(4-methylpiperazin-1-yl)phenyl]-4-ethoxybenzamide Traditional Name: 3-bromo-N-[3-chloro-2-(4-methylpiperazino)phenyl]-4-ethoxy-benzamide Formula: C20H23BrClN3O2 MolecularWeight: 452.77252

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C(=CC=C2)Cl)N3CCN(CC3)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=C(C(=CC=C2)Cl)N3CCN(CC3)C)Br

InChI

InChI=1S/C20H23BrClN3O2/c1-3-27-18-8-7-14(13-15(18)21)20(26)23-17-6-4-5-16(22)19(17)25-11-9-24(2)10-12-25/h4-8,13H,3,9-12H2,1-2H3,(H,23,26)