[(1S)-1-(4-dimethylaminophenyl)-2-(pentanoylamino)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(4-dimethylaminophenyl)-2-(pentanoylamino)ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(4-dimethylaminophenyl)-2-(pentanoylamino)ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(4-dimethylaminophenyl)-2-(1-oxopentylamino)ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(4-dimethylaminophenyl)-2-(pentanoylamino)ethyl]-dimethylazanium Traditional Name: [(1S)-1-(4-dimethylaminophenyl)-2-(valerylamino)ethyl]-dimethyl-ammonium Formula: C17H30N3O+ MolecularWeight: 292.4396

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NCC(C1=CC=C(C=C1)N(C)C)[NH+](C)C

Isomeric SMILES

CCCCC(=O)NC[C@H](C1=CC=C(C=C1)N(C)C)[NH+](C)C

InChI

InChI=1S/C17H29N3O/c1-6-7-8-17(21)18-13-16(20(4)5)14-9-11-15(12-10-14)19(2)3/h9-12,16H,6-8,13H2,1-5H3,(H,18,21)/p+1/t16-/m1/s1