(4-bromophenyl)methyl N-[1-[(1-cyclopentylcarbonyl-4-oxidanyl-4-phenyl-pyrrolidin-3-yl)methyl]piperidin-4-yl]-N-prop-2-enyl-carbamate

Systemtic Name: (4-bromophenyl)methyl N-[1-[(1-cyclopentylcarbonyl-4-oxidanyl-4-phenyl-pyrrolidin-3-yl)methyl]piperidin-4-yl]-N-prop-2-enyl-carbamate Openeye Name: (4-bromophenyl)methyl N-allyl-N-[1-[[1-(cyclopentanecarbonyl)-4-hydroxy-4-phenyl-pyrrolidin-3-yl]methyl]-4-piperidyl]carbamate CAS Name: N-[1-[[1-[cyclopentyl(oxo)methyl]-4-hydroxy-4-phenyl-3-pyrrolidinyl]methyl]-4-piperidinyl]-N-prop-2-enylcarbamic acid (4-bromophenyl)methyl ester IUPAC Name: (4-bromophenyl)methyl N-[1-[[1-(cyclopentanecarbonyl)-4-hydroxy-4-phenylpyrrolidin-3-yl]methyl]piperidin-4-yl]-N-prop-2-enylcarbamate Traditional Name: N-allyl-N-[1-[[1-(cyclopentanecarbonyl)-4-hydroxy-4-phenyl-pyrrolidin-3-yl]methyl]-4-piperidyl]carbamic acid (4-bromobenzyl) ester Formula: C33H42BrN3O4 MolecularWeight: 624.60828

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN(C1CCN(CC1)CC2CN(CC2(C3=CC=CC=C3)O)C(=O)C4CCCC4)C(=O)OCC5=CC=C(C=C5)Br

Isomeric SMILES

C=CCN(C1CCN(CC1)CC2CN(CC2(C3=CC=CC=C3)O)C(=O)C4CCCC4)C(=O)OCC5=CC=C(C=C5)Br

InChI

InChI=1S/C33H42BrN3O4/c1-2-18-37(32(39)41-23-25-12-14-29(34)15-13-25)30-16-19-35(20-17-30)21-28-22-36(31(38)26-8-6-7-9-26)24-33(28,40)27-10-4-3-5-11-27/h2-5,10-15,26,28,30,40H,1,6-9,16-24H2