[(1S)-2-[(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1S)-2-[(3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1S)-2-[(3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1S)-2-[(3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1S)-2-[(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1S)-2-[(3-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C17H20ClN2O+ MolecularWeight: 303.8065

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC=C1C=C(C=CC1=O)Cl)C2=CC=CC=C2

Isomeric SMILES

C[NH+](C)[C@H](CNC=C1C=C(C=CC1=O)Cl)C2=CC=CC=C2

InChI

InChI=1S/C17H19ClN2O/c1-20(2)16(13-6-4-3-5-7-13)12-19-11-14-10-15(18)8-9-17(14)21/h3-11,16,19H,12H2,1-2H3/p+1/t16-/m1/s1