8-[(E)-3-(3-nitrophenyl)prop-2-enyl]-8-aza-5-azoniaspiro[4.5]decane bromide

Systemtic Name: 8-[(E)-3-(3-nitrophenyl)prop-2-enyl]-8-aza-5-azoniaspiro[4.5]decane bromide Openeye Name: 8-[(E)-3-(3-nitrophenyl)allyl]-8-aza-5-azoniaspiro[4.5]decane bromide CAS Name: 8-[(E)-3-(3-nitrophenyl)prop-2-enyl]-8-aza-5-azoniaspiro[4.5]decane bromide IUPAC Name: 8-[(E)-3-(3-nitrophenyl)prop-2-enyl]-8-aza-5-azoniaspiro[4.5]decane bromide Traditional Name: 8-[(E)-3-(3-nitrophenyl)allyl]-8-aza-5-azoniaspiro[4.5]decane bromide Formula: C17H24BrN3O2 MolecularWeight: 382.29536

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+]2(C1)CCN(CC2)CC=CC3=CC(=CC=C3)[N+](=O)[O-].[Br-]

Isomeric SMILES

C1CC[N+]2(C1)CCN(CC2)C/C=C/C3=CC(=CC=C3)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C17H24N3O2.BrH/c21-19(22)17-7-3-5-16(15-17)6-4-8-18-9-13-20(14-10-18)11-1-2-12-20;/h3-7,15H,1-2,8-14H2;1H/q+1;/p-1/b6-4+;