[2-benzamido-3-[(2-chloranyl-4-nitro-phenyl)amino]-3-oxidanylidene-prop-1-enyl]-triphenyl-phosphanium perchlorate

Systemtic Name: [2-benzamido-3-[(2-chloranyl-4-nitro-phenyl)amino]-3-oxidanylidene-prop-1-enyl]-triphenyl-phosphanium perchlorate Openeye Name: [2-benzamido-3-(2-chloro-4-nitro-anilino)-3-oxo-prop-1-enyl]-triphenyl-phosphonium perchlorate CAS Name: [2-benzamido-3-(2-chloro-4-nitroanilino)-3-oxoprop-1-enyl]-triphenylphosphonium perchlorate IUPAC Name: [2-benzamido-3-(2-chloro-4-nitroanilino)-3-oxoprop-1-enyl]-triphenylphosphanium perchlorate Traditional Name: [2-benzamido-3-(2-chloro-4-nitro-anilino)-3-keto-prop-1-enyl]-triphenyl-phosphonium perchlorate Formula: C34H26Cl2N3O8P MolecularWeight: 706.465301

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NC5=C(C=C(C=C5)[N+](=O)[O-])Cl.[O-]Cl(=O)(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(=C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)NC5=C(C=C(C=C5)[N+](=O)[O-])Cl.[O-]Cl(=O)(=O)=O

InChI

InChI=1S/C34H25ClN3O4P.ClHO4/c35-30-23-26(38(41)42)21-22-31(30)36-34(40)32(37-33(39)25-13-5-1-6-14-25)24-43(27-15-7-2-8-16-27,28-17-9-3-10-18-28)29-19-11-4-12-20-29;2-1(3,4)5/h1-24H,(H-,36,37,39,40);(H,2,3,4,5)