(9R,10S)-10-[(2-bromophenyl)methyl]-9-(nitromethyl)-1,4-dioxaspiro[4.5]decane

Systemtic Name: (9R,10S)-10-[(2-bromophenyl)methyl]-9-(nitromethyl)-1,4-dioxaspiro[4.5]decane Openeye Name: (9R,10S)-10-[(2-bromophenyl)methyl]-9-(nitromethyl)-1,4-dioxaspiro[4.5]decane CAS Name: (9R,10S)-10-[(2-bromophenyl)methyl]-9-(nitromethyl)-1,4-dioxaspiro[4.5]decane IUPAC Name: (9R,10S)-10-[(2-bromophenyl)methyl]-9-(nitromethyl)-1,4-dioxaspiro[4.5]decane Traditional Name: (9R,10S)-10-(2-bromobenzyl)-9-(nitromethyl)-1,4-dioxaspiro[4.5]decane Formula: C16H20BrNO4 MolecularWeight: 370.2383

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(C2(C1)OCCO2)CC3=CC=CC=C3Br)C[N+](=O)[O-]

Isomeric SMILES

C1C[C@H]([C@@H](C2(C1)OCCO2)CC3=CC=CC=C3Br)C[N+](=O)[O-]

InChI

InChI=1S/C16H20BrNO4/c17-15-6-2-1-4-12(15)10-14-13(11-18(19)20)5-3-7-16(14)21-8-9-22-16/h1-2,4,6,13-14H,3,5,7-11H2/t13-,14-/m0/s1