diethyl-[(1S)-2-[[(1S,3R)-3-methylcyclohexyl]azaniumyl]-1-phenyl-ethyl]azanium

Systemtic Name: diethyl-[(1S)-2-[[(1S,3R)-3-methylcyclohexyl]azaniumyl]-1-phenyl-ethyl]azanium Openeye Name: diethyl-[(1S)-2-[[(1S,3R)-3-methylcyclohexyl]ammonio]-1-phenyl-ethyl]ammonium CAS Name: diethyl-[(1S)-2-[[(1S,3R)-3-methylcyclohexyl]ammonio]-1-phenylethyl]ammonium IUPAC Name: diethyl-[(1S)-2-[[(1S,3R)-3-methylcyclohexyl]azaniumyl]-1-phenylethyl]azanium Traditional Name: diethyl-[(1S)-2-[[(1S,3R)-3-methylcyclohexyl]ammonio]-1-phenyl-ethyl]ammonium Formula: C19H34N2+2 MolecularWeight: 290.48666

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C[NH2+]C1CCCC(C1)C)C2=CC=CC=C2

Isomeric SMILES

CC[NH+](CC)[C@H](C[NH2+][C@H]1CCC[C@H](C1)C)C2=CC=CC=C2

InChI

InChI=1S/C19H32N2/c1-4-21(5-2)19(17-11-7-6-8-12-17)15-20-18-13-9-10-16(3)14-18/h6-8,11-12,16,18-20H,4-5,9-10,13-15H2,1-3H3/p+2/t16-,18+,19-/m1/s1