(Z)-3-[decyl(phenylmethoxycarbonyl)amino]-1-diazonio-prop-1-en-2-olate

Systemtic Name: (Z)-3-[decyl(phenylmethoxycarbonyl)amino]-1-diazonio-prop-1-en-2-olate Openeye Name: (Z)-3-[benzyloxycarbonyl(decyl)amino]-1-diazonio-prop-1-en-2-olate CAS Name: (Z)-3-[decyl(phenylmethoxycarbonyl)amino]-1-diazonio-1-propen-2-olate IUPAC Name: (Z)-3-[decyl(phenylmethoxycarbonyl)amino]-1-diazonioprop-1-en-2-olate Traditional Name: (Z)-3-[carbobenzoxy(decyl)amino]-1-diazonio-prop-1-en-2-olate Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCN(CC(=C[N+]#N)[O-])C(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCN(C/C(=C/[N+]#N)/[O-])C(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C21H31N3O3/c1-2-3-4-5-6-7-8-12-15-24(17-20(25)16-23-22)21(26)27-18-19-13-10-9-11-14-19/h9-11,13-14,16H,2-8,12,15,17-18H2,1H3/b20-16-