3-[[(1S)-cyclohex-3-en-1-yl]methylazaniumyl]propyl-methyl-(phenylmethyl)azanium

Systemtic Name: 3-[[(1S)-cyclohex-3-en-1-yl]methylazaniumyl]propyl-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[3-[[(1S)-cyclohex-3-en-1-yl]methylammonio]propyl]-methyl-ammonium CAS Name: 3-[[(1S)-1-cyclohex-3-enyl]methylammonio]propyl-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[3-[[(1S)-cyclohex-3-en-1-yl]methylazaniumyl]propyl]-methylazanium Traditional Name: benzyl-[3-[[(1S)-cyclohex-3-en-1-yl]methylammonio]propyl]-methyl-ammonium Formula: C18H30N2+2 MolecularWeight: 274.4442

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC[NH2+]CC1CCC=CC1)CC2=CC=CC=C2

Isomeric SMILES

C[NH+](CCC[NH2+]C[C@H]1CCC=CC1)CC2=CC=CC=C2

InChI

InChI=1S/C18H28N2/c1-20(16-18-11-6-3-7-12-18)14-8-13-19-15-17-9-4-2-5-10-17/h2-4,6-7,11-12,17,19H,5,8-10,13-16H2,1H3/p+2/t17-/m1/s1