[(E)-4-(3-chlorophenyl)but-2-enyl]-diethyl-heptyl-azanium

Systemtic Name: [(E)-4-(3-chlorophenyl)but-2-enyl]-diethyl-heptyl-azanium Openeye Name: [(E)-4-(3-chlorophenyl)but-2-enyl]-diethyl-heptyl-ammonium CAS Name: [(E)-4-(3-chlorophenyl)but-2-enyl]-diethyl-heptylammonium IUPAC Name: [(E)-4-(3-chlorophenyl)but-2-enyl]-diethyl-heptylazanium Traditional Name: [(E)-4-(3-chlorophenyl)but-2-enyl]-diethyl-heptyl-ammonium Formula: C21H35ClN+ MolecularWeight: 336.9623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+](CC)(CC)CC=CCC1=CC(=CC=C1)Cl

Isomeric SMILES

CCCCCCC[N+](CC)(CC)C/C=C/CC1=CC(=CC=C1)Cl

InChI

InChI=1S/C21H35ClN/c1-4-7-8-9-11-17-23(5-2,6-3)18-12-10-14-20-15-13-16-21(22)19-20/h10,12-13,15-16,19H,4-9,11,14,17-18H2,1-3H3/q+1/b12-10+