[(4S)-4-[[(1R)-1-(4-cyanophenyl)ethyl]azaniumyl]pentyl]-diethyl-azanium

Systemtic Name: [(4S)-4-[[(1R)-1-(4-cyanophenyl)ethyl]azaniumyl]pentyl]-diethyl-azanium Openeye Name: [(4S)-4-[[(1R)-1-(4-cyanophenyl)ethyl]ammonio]pentyl]-diethyl-ammonium CAS Name: [(4S)-4-[[(1R)-1-(4-cyanophenyl)ethyl]ammonio]pentyl]-diethylammonium IUPAC Name: [(4S)-4-[[(1R)-1-(4-cyanophenyl)ethyl]azaniumyl]pentyl]-diethylazanium Traditional Name: [(4S)-4-[[(1R)-1-(4-cyanophenyl)ethyl]ammonio]pentyl]-diethyl-ammonium Formula: C18H31N3+2 MolecularWeight: 289.45884

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCC(C)[NH2+]C(C)C1=CC=C(C=C1)C#N

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3/c1-5-21(6-2)13-7-8-15(3)20-16(4)18-11-9-17(14-19)10-12-18/h9-12,15-16,20H,5-8,13H2,1-4H3/p+2/t15-,16+/m0/s1