[(Z,2S)-1-azaniumyl-4-phenyl-but-3-en-2-yl]-(phenylmethyl)-propan-2-yl-azanium

Systemtic Name: [(Z,2S)-1-azaniumyl-4-phenyl-but-3-en-2-yl]-(phenylmethyl)-propan-2-yl-azanium Openeye Name: [(Z,1S)-1-(azaniumylmethyl)-3-phenyl-allyl]-benzyl-isopropyl-ammonium CAS Name: [(Z,2S)-1-ammonio-4-phenylbut-3-en-2-yl]-(phenylmethyl)-propan-2-ylammonium IUPAC Name: [(Z,2S)-1-azaniumyl-4-phenylbut-3-en-2-yl]-benzyl-propan-2-ylazanium Traditional Name: [(Z,1S)-1-(ammoniomethyl)-3-phenyl-allyl]-benzyl-isopropyl-ammonium Formula: C20H28N2+2 MolecularWeight: 296.44972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=CC=CC=C1)C(C[NH3+])C=CC2=CC=CC=C2

Isomeric SMILES

CC(C)[NH+](CC1=CC=CC=C1)[C@H](C[NH3+])/C=C\C2=CC=CC=C2

InChI

InChI=1S/C20H26N2/c1-17(2)22(16-19-11-7-4-8-12-19)20(15-21)14-13-18-9-5-3-6-10-18/h3-14,17,20H,15-16,21H2,1-2H3/p+2/b14-13-/t20-/m0/s1