[(1S)-1-phenylethyl]-[(4R,5R)-5-[[(1S)-1-phenylethyl]azaniumyl]octa-1,7-dien-4-yl]azanium dichloride

Systemtic Name: [(1S)-1-phenylethyl]-[(4R,5R)-5-[[(1S)-1-phenylethyl]azaniumyl]octa-1,7-dien-4-yl]azanium dichloride Openeye Name: [(1R,2R)-1-allyl-2-[[(1S)-1-phenylethyl]ammonio]pent-4-enyl]-[(1S)-1-phenylethyl]ammonium dichloride CAS Name: [(1S)-1-phenylethyl]-[(4R,5R)-5-[[(1S)-1-phenylethyl]ammonio]octa-1,7-dien-4-yl]ammonium dichloride IUPAC Name: [(1S)-1-phenylethyl]-[(4R,5R)-5-[[(1S)-1-phenylethyl]azaniumyl]octa-1,7-dien-4-yl]azanium dichloride Traditional Name: [(1R,2R)-1-allyl-2-[[(1S)-1-phenylethyl]ammonio]pent-4-enyl]-[(1S)-1-phenylethyl]ammonium dichloride Formula: C24H34Cl2N2 MolecularWeight: 421.44616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)[NH2+]C(CC=C)C(CC=C)[NH2+]C(C)C2=CC=CC=C2.[Cl-].[Cl-]

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)[NH2+][C@H](CC=C)[C@@H](CC=C)[NH2+][C@@H](C)C2=CC=CC=C2.[Cl-].[Cl-]

InChI

InChI=1S/C24H32N2.2ClH/c1-5-13-23(25-19(3)21-15-9-7-10-16-21)24(14-6-2)26-20(4)22-17-11-8-12-18-22;;/h5-12,15-20,23-26H,1-2,13-14H2,3-4H3;2*1H/t19-,20-,23+,24+;;/m0../s1