N-[(1R,2R)-2-cyclopentylcyclopentyl]-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine bromide

Systemtic Name: N-[(1R,2R)-2-cyclopentylcyclopentyl]-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine bromide Openeye Name: N-[(1R,2R)-2-cyclopentylcyclopentyl]-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine bromide CAS Name: N-[(1R,2R)-2-cyclopentylcyclopentyl]-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine bromide IUPAC Name: N-[(1R,2R)-2-cyclopentylcyclopentyl]-3,4,5,6-tetrahydro-2H-azepin-1-ium-7-amine bromide Traditional Name: [(1R,2R)-2-cyclopentylcyclopentyl]-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-yl)amine bromide Formula: C16H29BrN2 MolecularWeight: 329.31886

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=[NH+]CC1)NC2CCCC2C3CCCC3.[Br-]

Isomeric SMILES

C1CCC(=[NH+]CC1)N[C@@H]2CCC[C@@H]2C3CCCC3.[Br-]

InChI

InChI=1S/C16H28N2.BrH/c1-2-11-16(17-12-5-1)18-15-10-6-9-14(15)13-7-3-4-8-13;/h13-15H,1-12H2,(H,17,18);1H/t14-,15-;/m1./s1