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

Systemtic Name: N-[(3-bromophenyl)methyl]-1-[(2,6-dimethyl-2,3-dihydro-1,4-benzoxazin-4-yl)carbonyl]piperidine-3-carboxamide Openeye Name: N-[(3-bromophenyl)methyl]-1-(2,6-dimethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)piperidine-3-carboxamide CAS Name: N-[(3-bromophenyl)methyl]-1-[(2,6-dimethyl-2,3-dihydro-1,4-benzoxazin-4-yl)-oxomethyl]-3-piperidinecarboxamide IUPAC Name: N-[(3-bromophenyl)methyl]-1-(2,6-dimethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)piperidine-3-carboxamide Traditional Name: N-(3-bromobenzyl)-1-(2,6-dimethyl-2,3-dihydro-1,4-benzoxazine-4-carbonyl)nipecotamide 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)N3CCCC(C3)C(=O)NCC4=CC(=CC=C4)Br

Isomeric SMILES

CC1CN(C2=C(O1)C=CC(=C2)C)C(=O)N3CCCC(C3)C(=O)NCC4=CC(=CC=C4)Br

InChI

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