(Z,3S)-2-diazonio-1-methoxy-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]but-1-en-1-olate

Systemtic Name: (Z,3S)-2-diazonio-1-methoxy-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]but-1-en-1-olate Openeye Name: (Z,3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-2-diazonio-1-methoxy-but-1-en-1-olate CAS Name: (Z,3S)-2-diazonio-1-methoxy-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]-1-buten-1-olate IUPAC Name: (Z,3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-2-diazonio-1-methoxybut-1-en-1-olate Traditional Name: (Z,3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-2-diazonio-1-methoxy-but-1-en-1-olate Formula: C20H23N3O2 MolecularWeight: 337.41552

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N(CC2=CC=CC=C2)C(C)C(=C([O-])OC)[N+]#N

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)N(CC2=CC=CC=C2)[C@@H](C)/C(=C(\[O-])/OC)/[N+]#N

InChI

InChI=1S/C20H23N3O2/c1-15(18-12-8-5-9-13-18)23(14-17-10-6-4-7-11-17)16(2)19(22-21)20(24)25-3/h4-13,15-16H,14H2,1-3H3/b20-19-/t15-,16-/m0/s1