3-bromanyl-N-[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]-4-(2-methylpropoxy)benzamide

Systemtic Name: 3-bromanyl-N-[2-[4-(diphenylmethyl)piperazin-1-yl]carbonylphenyl]-4-(2-methylpropoxy)benzamide Openeye Name: N-[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]-3-bromo-4-isobutoxy-benzamide CAS Name: 3-bromo-N-[2-[[4-(diphenylmethyl)-1-piperazinyl]-oxomethyl]phenyl]-4-(2-methylpropoxy)benzamide IUPAC Name: N-[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]-3-bromo-4-(2-methylpropoxy)benzamide Traditional Name: N-[2-(4-benzhydrylpiperazine-1-carbonyl)phenyl]-3-bromo-4-isobutoxy-benzamide Formula: C35H36BrN3O3 MolecularWeight: 626.58264

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)Br

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=CC=C5)Br

InChI

InChI=1S/C35H36BrN3O3/c1-25(2)24-42-32-18-17-28(23-30(32)36)34(40)37-31-16-10-9-15-29(31)35(41)39-21-19-38(20-22-39)33(26-11-5-3-6-12-26)27-13-7-4-8-14-27/h3-18,23,25,33H,19-22,24H2,1-2H3,(H,37,40)