dimethyl 2-[(5-bromanylpyridin-2-yl)amino]-3-(triphenyl-$l^{5}-phosphanylidene)butanedioate

Systemtic Name: dimethyl 2-[(5-bromanylpyridin-2-yl)amino]-3-(triphenyl-$l^{5}-phosphanylidene)butanedioate Openeye Name: dimethyl 2-[(5-bromo-2-pyridyl)amino]-3-(triphenyl-$l^{5}-phosphanylidene)butanedioate CAS Name: 2-[(5-bromo-2-pyridinyl)amino]-3-triphenylphosphoranylidenebutanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(5-bromopyridin-2-yl)amino]-3-(triphenyl-$l^{5}-phosphanylidene)butanedioate Traditional Name: 2-[(5-bromo-2-pyridyl)amino]-3-triphenylphosphoranylidene-succinic acid dimethyl ester Formula: C29H26BrN2O4P MolecularWeight: 577.405501

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)NC4=NC=C(C=C4)Br

Isomeric SMILES

COC(=O)C(C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)OC)NC4=NC=C(C=C4)Br

InChI

InChI=1S/C29H26BrN2O4P/c1-35-28(33)26(32-25-19-18-21(30)20-31-25)27(29(34)36-2)37(22-12-6-3-7-13-22,23-14-8-4-9-15-23)24-16-10-5-11-17-24/h3-20,26H,1-2H3,(H,31,32)