(Z)-1-methoxy-3-[(4-nitrophenyl)carbonylamino]-3-sulfanylidene-2-triphenylphosphaniumyl-prop-1-en-1-olate

Systemtic Name: (Z)-1-methoxy-3-[(4-nitrophenyl)carbonylamino]-3-sulfanylidene-2-triphenylphosphaniumyl-prop-1-en-1-olate Openeye Name: (Z)-1-methoxy-3-[(4-nitrobenzoyl)amino]-3-thioxo-2-triphenylphosphaniumyl-prop-1-en-1-olate CAS Name: (Z)-1-methoxy-3-[[(4-nitrophenyl)-oxomethyl]amino]-3-sulfanylidene-2-triphenylphosphiniumyl-1-propen-1-olate IUPAC Name: (Z)-1-methoxy-3-[(4-nitrobenzoyl)amino]-3-sulfanylidene-2-triphenylphosphaniumylprop-1-en-1-olate Traditional Name: (Z)-1-methoxy-3-[(4-nitrobenzoyl)amino]-3-thioxo-2-triphenylphosphiniumyl-prop-1-en-1-olate Formula: C29H23N2O5PS MolecularWeight: 542.542081

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Descriptors Computed from Structure

Canonical SMILES:

COC(=C(C(=S)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-])[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)[O-]

Isomeric SMILES

CO/C(=C(/C(=S)NC(=O)C1=CC=C(C=C1)[N+](=O)[O-])\[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)/[O-]

InChI

InChI=1S/C29H23N2O5PS/c1-36-29(33)26(28(38)30-27(32)21-17-19-22(20-18-21)31(34)35)37(23-11-5-2-6-12-23,24-13-7-3-8-14-24)25-15-9-4-10-16-25/h2-20H,1H3,(H-,30,32,33,38)