di(propan-2-yl)-[2-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)ethyl]azanium

Systemtic Name: di(propan-2-yl)-[2-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)ethyl]azanium Openeye Name: diisopropyl-[2-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)ethyl]ammonium CAS Name: di(propan-2-yl)-[2-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)ethyl]ammonium IUPAC Name: di(propan-2-yl)-[2-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)ethyl]azanium Traditional Name: diisopropyl-[2-(3,4,5,6-tetrahydro-2H-azepin-1-ium-7-ylamino)ethyl]ammonium Formula: C14H31N3+2 MolecularWeight: 241.41604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC1=[NH+]CCCCC1)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC1=[NH+]CCCCC1)C(C)C

InChI

InChI=1S/C14H29N3/c1-12(2)17(13(3)4)11-10-16-14-8-6-5-7-9-15-14/h12-13H,5-11H2,1-4H3,(H,15,16)/p+2