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

Systemtic Name: [(1S)-2-(2-acetyloxyethanoylamino)-1-(4-dimethylaminophenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(2-acetoxyacetyl)amino]-1-(4-dimethylaminophenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[(2-acetyloxy-1-oxoethyl)amino]-1-(4-dimethylaminophenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(2-acetyloxyacetyl)amino]-1-(4-dimethylaminophenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[(2-acetoxyacetyl)amino]-1-(4-dimethylaminophenyl)ethyl]-dimethyl-ammonium Formula: C16H26N3O3+ MolecularWeight: 308.39594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O3/c1-12(20)22-11-16(21)17-10-15(19(4)5)13-6-8-14(9-7-13)18(2)3/h6-9,15H,10-11H2,1-5H3,(H,17,21)/p+1/t15-/m1/s1