N-[2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]-3-fluoranyl-benzamide

Systemtic Name: N-[2-[4-(3,4-dimethoxyphenyl)carbonylpiperazin-1-yl]-5-piperazin-1-ylcarbonyl-phenyl]-3-fluoranyl-benzamide Openeye Name: N-[2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]-3-fluoro-benzamide CAS Name: N-[2-[4-[(3,4-dimethoxyphenyl)-oxomethyl]-1-piperazinyl]-5-[oxo(1-piperazinyl)methyl]phenyl]-3-fluorobenzamide IUPAC Name: N-[2-[4-(3,4-dimethoxybenzoyl)piperazin-1-yl]-5-(piperazine-1-carbonyl)phenyl]-3-fluorobenzamide Traditional Name: 3-fluoro-N-[5-(piperazine-1-carbonyl)-2-(4-veratroylpiperazino)phenyl]benzamide Formula: C31H34FN5O5 MolecularWeight: 575.630563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCNCC4)NC(=O)C5=CC(=CC=C5)F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)N4CCNCC4)NC(=O)C5=CC(=CC=C5)F)OC

InChI

InChI=1S/C31H34FN5O5/c1-41-27-9-7-23(20-28(27)42-2)31(40)37-16-14-35(15-17-37)26-8-6-22(30(39)36-12-10-33-11-13-36)19-25(26)34-29(38)21-4-3-5-24(32)18-21/h3-9,18-20,33H,10-17H2,1-2H3,(H,34,38)