diethyl-[(1S)-2-(3-methylbutylazaniumyl)-1-phenyl-ethyl]azanium

Systemtic Name: diethyl-[(1S)-2-(3-methylbutylazaniumyl)-1-phenyl-ethyl]azanium Openeye Name: diethyl-[(1S)-2-(isopentylammonio)-1-phenyl-ethyl]ammonium CAS Name: diethyl-[(1S)-2-(3-methylbutylammonio)-1-phenylethyl]ammonium IUPAC Name: diethyl-[(1S)-2-(3-methylbutylazaniumyl)-1-phenylethyl]azanium Traditional Name: diethyl-[(1S)-2-(isoamylammonio)-1-phenyl-ethyl]ammonium Formula: C17H32N2+2 MolecularWeight: 264.44938

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(C[NH2+]CCC(C)C)C1=CC=CC=C1

Isomeric SMILES

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

InChI

InChI=1S/C17H30N2/c1-5-19(6-2)17(14-18-13-12-15(3)4)16-10-8-7-9-11-16/h7-11,15,17-18H,5-6,12-14H2,1-4H3/p+2/t17-/m1/s1