[(Z)-2-benzamido-3-[(2,4-dinitrophenyl)amino]-3-oxidanylidene-1-phenyl-prop-1-enyl]-triphenyl-phosphanium

Systemtic Name: [(Z)-2-benzamido-3-[(2,4-dinitrophenyl)amino]-3-oxidanylidene-1-phenyl-prop-1-enyl]-triphenyl-phosphanium Openeye Name: [(Z)-2-benzamido-3-(2,4-dinitroanilino)-3-oxo-1-phenyl-prop-1-enyl]-triphenyl-phosphonium CAS Name: [(Z)-2-benzamido-3-(2,4-dinitroanilino)-3-oxo-1-phenylprop-1-enyl]-triphenylphosphonium IUPAC Name: [(Z)-2-benzamido-3-(2,4-dinitroanilino)-3-oxo-1-phenylprop-1-enyl]-triphenylphosphanium Traditional Name: [(Z)-2-benzamido-3-(2,4-dinitroanilino)-3-keto-1-phenyl-prop-1-enyl]-triphenyl-phosphonium Formula: C40H30N4O6P+ MolecularWeight: 693.663161

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C(C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])NC(=O)C3=CC=CC=C3)[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)/C(=C(\C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])/NC(=O)C3=CC=CC=C3)/[P+](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C40H29N4O6P/c45-39(30-18-8-2-9-19-30)42-37(40(46)41-35-27-26-31(43(47)48)28-36(35)44(49)50)38(29-16-6-1-7-17-29)51(32-20-10-3-11-21-32,33-22-12-4-13-23-33)34-24-14-5-15-25-34/h1-28H,(H-,41,42,45,46)/p+1/b38-37-