[(1S)-1-(4-dimethylaminophenyl)-2-[(4-ethoxy-4-oxidanylidene-butanoyl)amino]ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(4-ethoxy-4-oxidanylidene-butanoyl)amino]ethyl]-dimethyl-azanium Openeye Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(4-ethoxy-4-oxo-butanoyl)amino]ethyl]-dimethyl-ammonium CAS Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(4-ethoxy-1,4-dioxobutyl)amino]ethyl]-dimethylammonium IUPAC Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(4-ethoxy-4-oxobutanoyl)amino]ethyl]-dimethylazanium Traditional Name: [(1S)-1-(4-dimethylaminophenyl)-2-[(4-ethoxy-4-keto-butanoyl)amino]ethyl]-dimethyl-ammonium Formula: C18H30N3O3+ MolecularWeight: 336.4491

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H29N3O3/c1-6-24-18(23)12-11-17(22)19-13-16(21(4)5)14-7-9-15(10-8-14)20(2)3/h7-10,16H,6,11-13H2,1-5H3,(H,19,22)/p+1/t16-/m1/s1