aminocarbonyl-butyl-methyl-[3-[(2-methyl-2-propyl-pent-4-enoyl)amino]phenyl]azanium

Systemtic Name: aminocarbonyl-butyl-methyl-[3-[(2-methyl-2-propyl-pent-4-enoyl)amino]phenyl]azanium Openeye Name: butyl-carbamoyl-methyl-[3-[(2-methyl-2-propyl-pent-4-enoyl)amino]phenyl]ammonium CAS Name: butyl-carbamoyl-methyl-[3-[(2-methyl-1-oxo-2-propylpent-4-enyl)amino]phenyl]ammonium IUPAC Name: butyl-carbamoyl-methyl-[3-[(2-methyl-2-propylpent-4-enoyl)amino]phenyl]azanium Traditional Name: butyl-carbamoyl-methyl-[3-[(2-methyl-2-propyl-pent-4-enoyl)amino]phenyl]ammonium Formula: C21H34N3O2+ MolecularWeight: 360.51356

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+](C)(C1=CC=CC(=C1)NC(=O)C(C)(CCC)CC=C)C(=O)N

Isomeric SMILES

CCCC[N+](C)(C1=CC=CC(=C1)NC(=O)C(C)(CCC)CC=C)C(=O)N

InChI

InChI=1S/C21H33N3O2/c1-6-9-15-24(5,20(22)26)18-12-10-11-17(16-18)23-19(25)21(4,13-7-2)14-8-3/h7,10-12,16H,2,6,8-9,13-15H2,1,3-5H3,(H2-,22,23,25,26)/p+1