(1S,6R)-N-(2-bromophenyl)-N-(methoxymethyl)-9-methylidene-8-oxidanylidene-7-(phenylmethyl)-7-azabicyclo[4.2.1]non-3-ene-4-carboxamide

Systemtic Name: (1S,6R)-N-(2-bromophenyl)-N-(methoxymethyl)-9-methylidene-8-oxidanylidene-7-(phenylmethyl)-7-azabicyclo[4.2.1]non-3-ene-4-carboxamide Openeye Name: (1S,6R)-7-benzyl-N-(2-bromophenyl)-N-(methoxymethyl)-9-methylene-8-oxo-7-azabicyclo[4.2.1]non-3-ene-4-carboxamide CAS Name: (1S,6R)-N-(2-bromophenyl)-N-(methoxymethyl)-9-methylene-8-oxo-7-(phenylmethyl)-7-azabicyclo[4.2.1]non-3-ene-4-carboxamide IUPAC Name: (1S,6R)-7-benzyl-N-(2-bromophenyl)-N-(methoxymethyl)-9-methylidene-8-oxo-7-azabicyclo[4.2.1]non-3-ene-4-carboxamide Traditional Name: (1S,6R)-7-benzyl-N-(2-bromophenyl)-8-keto-N-(methoxymethyl)-9-methylene-7-azabicyclo[4.2.1]non-3-ene-4-carboxamide Formula: C25H25BrN2O3 MolecularWeight: 481.3816

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Descriptors Computed from Structure

Canonical SMILES:

COCN(C1=CC=CC=C1Br)C(=O)C2=CCC3C(=C)C(C2)N(C3=O)CC4=CC=CC=C4

Isomeric SMILES

COCN(C1=CC=CC=C1Br)C(=O)C2=CC[C@H]3C(=C)[C@@H](C2)N(C3=O)CC4=CC=CC=C4

InChI

InChI=1S/C25H25BrN2O3/c1-17-20-13-12-19(24(29)28(16-31-2)22-11-7-6-10-21(22)26)14-23(17)27(25(20)30)15-18-8-4-3-5-9-18/h3-12,20,23H,1,13-16H2,2H3/t20-,23+/m0/s1