[(1S)-2-[[(2S)-2-cyano-3-ethoxy-3-oxidanylidene-propylidene]amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[[(2S)-2-cyano-3-ethoxy-3-oxidanylidene-propylidene]amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[[(2S)-2-cyano-3-ethoxy-3-oxo-propylidene]amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[[(2S)-2-cyano-3-ethoxy-3-oxopropylidene]amino]-1-(3-methoxyphenyl)ethyl]-dimethylammonium IUPAC Name: [(1S)-2-[[(2S)-2-cyano-3-ethoxy-3-oxopropylidene]amino]-1-(3-methoxyphenyl)ethyl]-dimethylazanium Traditional Name: [(1S)-2-[[(2S)-2-cyano-3-ethoxy-3-keto-propylidene]amino]-1-(3-methoxyphenyl)ethyl]-dimethyl-ammonium Formula: C17H24N3O3+ MolecularWeight: 318.39076

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O3/c1-5-23-17(21)14(10-18)11-19-12-16(20(2)3)13-7-6-8-15(9-13)22-4/h6-9,11,14,16H,5,12H2,1-4H3/p+1/t14-,16-/m1/s1