N-[(2-bromophenyl)methyl]-1-[(2,6-dimethyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonyl]piperidine-4-carboxamide

Systemtic Name: N-[(2-bromophenyl)methyl]-1-[(2,6-dimethyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonyl]piperidine-4-carboxamide Openeye Name: N-[(2-bromophenyl)methyl]-1-(2,6-dimethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide CAS Name: N-[(2-bromophenyl)methyl]-1-[(2,6-dimethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-oxomethyl]-4-piperidinecarboxamide IUPAC Name: N-[(2-bromophenyl)methyl]-1-(2,6-dimethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)piperidine-4-carboxamide Traditional Name: N-(2-bromobenzyl)-1-(2,6-dimethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)isonipecotamide Formula: C24H28BrN3O3 MolecularWeight: 486.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(C2=C(O1)C=CC(=C2)C)C(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4Br

Isomeric SMILES

CC1CN(C2=C(O1)C=CC(=C2)C)C(=O)N3CCC(CC3)C(=O)NCC4=CC=CC=C4Br

InChI

InChI=1S/C24H28BrN3O3/c1-16-7-8-22-21(13-16)28(15-17(2)31-22)24(30)27-11-9-18(10-12-27)23(29)26-14-19-5-3-4-6-20(19)25/h3-8,13,17-18H,9-12,14-15H2,1-2H3,(H,26,29)