heptan-4-yl-[(1S,2R)-2-methylcyclohexyl]azanium

Systemtic Name: heptan-4-yl-[(1S,2R)-2-methylcyclohexyl]azanium Openeye Name: [(1S,2R)-2-methylcyclohexyl]-(1-propylbutyl)ammonium CAS Name: heptan-4-yl-[(1S,2R)-2-methylcyclohexyl]ammonium IUPAC Name: heptan-4-yl-[(1S,2R)-2-methylcyclohexyl]azanium Traditional Name: [(1S,2R)-2-methylcyclohexyl]-(1-propylbutyl)ammonium Formula: C14H30N+ MolecularWeight: 212.3947

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)[NH2+]C1CCCCC1C

Isomeric SMILES

CCCC(CCC)[NH2+][C@H]1CCCC[C@H]1C

InChI

InChI=1S/C14H29N/c1-4-8-13(9-5-2)15-14-11-7-6-10-12(14)3/h12-15H,4-11H2,1-3H3/p+1/t12-,14+/m1/s1