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diethyl-heptyl-[(E)-4-[4-(methylcarbamoylamino)phenyl]but-2-enyl]azanium

diethyl-heptyl-[(E)-4-[4-(methylcarbamoylamino)phenyl]but-2-enyl]azanium

Systemtic Name:diethyl-heptyl-[(E)-4-[4-(methylcarbamoylamino)phenyl]but-2-enyl]azanium
Openeye Name:diethyl-heptyl-[(E)-4-[4-(methylcarbamoylamino)phenyl]but-2-enyl]ammonium
CAS Name:diethyl-heptyl-[(E)-4-[4-(methylcarbamoylamino)phenyl]but-2-enyl]ammonium
IUPAC Name:diethyl-heptyl-[(E)-4-[4-(methylcarbamoylamino)phenyl]but-2-enyl]azanium
Traditional Name:diethyl-heptyl-[(E)-4-[4-(methylcarbamoylamino)phenyl]but-2-enyl]ammonium
Formula: C23H40N3O+
MolecularWeight: 374.5832
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC[N+](CC)(CC)CC=CCC1=CC=C(C=C1)NC(=O)NC


Isomeric SMILES

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


InChI

InChI=1S/C23H39N3O/c1-5-8-9-10-12-19-26(6-2,7-3)20-13-11-14-21-15-17-22(18-16-21)25-23(27)24-4/h11,13,15-18H,5-10,12,14,19-20H2,1-4H3,(H-,24,25,27)/p+1/b13-11+


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