ethyl 3-(4-chlorophenyl)-4-nitro-2-(triphenyl-$l^{5}-phosphanylidene)butanoate

Systemtic Name: ethyl 3-(4-chlorophenyl)-4-nitro-2-(triphenyl-$l^{5}-phosphanylidene)butanoate Openeye Name: ethyl 3-(4-chlorophenyl)-4-nitro-2-(triphenyl-$l^{5}-phosphanylidene)butanoate CAS Name: 3-(4-chlorophenyl)-4-nitro-2-triphenylphosphoranylidenebutanoic acid ethyl ester IUPAC Name: ethyl 3-(4-chlorophenyl)-4-nitro-2-(triphenyl-$l^{5}-phosphanylidene)butanoate Traditional Name: 3-(4-chlorophenyl)-4-nitro-2-triphenylphosphoranylidene-butyric acid ethyl ester Formula: C30H27ClNO4P MolecularWeight: 531.966441

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(C[N+](=O)[O-])C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)C(=P(C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3)C(C[N+](=O)[O-])C4=CC=C(C=C4)Cl

InChI

InChI=1S/C30H27ClNO4P/c1-2-36-30(33)29(28(22-32(34)35)23-18-20-24(31)21-19-23)37(25-12-6-3-7-13-25,26-14-8-4-9-15-26)27-16-10-5-11-17-27/h3-21,28H,2,22H2,1H3