[(2R)-2-[4-[(5-bromanyl-2-ethoxy-phenyl)methyl]piperazin-1-yl]carbonylpyrrolidin-1-yl]-cyclohexyl-methanone

Systemtic Name: [(2R)-2-[4-[(5-bromanyl-2-ethoxy-phenyl)methyl]piperazin-1-yl]carbonylpyrrolidin-1-yl]-cyclohexyl-methanone Openeye Name: [(2R)-2-[4-[(5-bromo-2-ethoxy-phenyl)methyl]piperazine-1-carbonyl]pyrrolidin-1-yl]-cyclohexyl-methanone CAS Name: [(2R)-2-[[4-[(5-bromo-2-ethoxyphenyl)methyl]-1-piperazinyl]-oxomethyl]-1-pyrrolidinyl]-cyclohexylmethanone IUPAC Name: [(2R)-2-[4-[(5-bromo-2-ethoxyphenyl)methyl]piperazine-1-carbonyl]pyrrolidin-1-yl]-cyclohexylmethanone Traditional Name: [(2R)-2-[4-(5-bromo-2-ethoxy-benzyl)piperazine-1-carbonyl]pyrrolidino]-cyclohexyl-methanone Formula: C25H36BrN3O3 MolecularWeight: 506.47564

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)CN2CCN(CC2)C(=O)C3CCCN3C(=O)C4CCCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)CN2CCN(CC2)C(=O)[C@H]3CCCN3C(=O)C4CCCCC4

InChI

InChI=1S/C25H36BrN3O3/c1-2-32-23-11-10-21(26)17-20(23)18-27-13-15-28(16-14-27)25(31)22-9-6-12-29(22)24(30)19-7-4-3-5-8-19/h10-11,17,19,22H,2-9,12-16,18H2,1H3/t22-/m1/s1