(3R)-1-[2-[(4-bromophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-3-carboxamide

Systemtic Name: (3R)-1-[2-[(4-bromophenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]-N-phenyl-piperidine-3-carboxamide Openeye Name: (3R)-1-[2-[(4-bromophenyl)methyl-methyl-amino]-2-oxo-ethyl]-N-phenyl-piperidine-3-carboxamide CAS Name: (3R)-1-[2-[(4-bromophenyl)methyl-methylamino]-2-oxoethyl]-N-phenyl-3-piperidinecarboxamide IUPAC Name: (3R)-1-[2-[(4-bromophenyl)methyl-methylamino]-2-oxoethyl]-N-phenylpiperidine-3-carboxamide Traditional Name: (3R)-1-[2-[(4-bromobenzyl)-methyl-amino]-2-keto-ethyl]-N-phenyl-nipecotamide Formula: C22H26BrN3O2 MolecularWeight: 444.36474

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)Br)C(=O)CN2CCCC(C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=C(C=C1)Br)C(=O)CN2CCC[C@H](C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H26BrN3O2/c1-25(14-17-9-11-19(23)12-10-17)21(27)16-26-13-5-6-18(15-26)22(28)24-20-7-3-2-4-8-20/h2-4,7-12,18H,5-6,13-16H2,1H3,(H,24,28)/t18-/m1/s1