(E)-2-diazonio-1-ethoxy-3-oxidanylidene-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]prop-1-en-1-olate

Systemtic Name: (E)-2-diazonio-1-ethoxy-3-oxidanylidene-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]prop-1-en-1-olate Openeye Name: (E)-3-[benzyl-[(1S)-1-phenylethyl]amino]-2-diazonio-1-ethoxy-3-oxo-prop-1-en-1-olate CAS Name: (E)-2-diazonio-1-ethoxy-3-oxo-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]-1-propen-1-olate IUPAC Name: (E)-3-[benzyl-[(1S)-1-phenylethyl]amino]-2-diazonio-1-ethoxy-3-oxoprop-1-en-1-olate Traditional Name: (E)-3-[benzyl-[(1S)-1-phenylethyl]amino]-2-diazonio-1-ethoxy-3-keto-prop-1-en-1-olate Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C(C(=O)N(CC1=CC=CC=C1)C(C)C2=CC=CC=C2)[N+]#N)[O-]

Isomeric SMILES

CCO/C(=C(\C(=O)N(CC1=CC=CC=C1)[C@@H](C)C2=CC=CC=C2)/[N+]#N)/[O-]

InChI

InChI=1S/C20H21N3O3/c1-3-26-20(25)18(22-21)19(24)23(14-16-10-6-4-7-11-16)15(2)17-12-8-5-9-13-17/h4-13,15H,3,14H2,1-2H3/t15-/m0/s1