2-[[2-oxidanylidene-2-(2-phenylindolizin-3-yl)ethanoyl]amino]ethyl 4-nitrobenzoate

Systemtic Name: 2-[[2-oxidanylidene-2-(2-phenylindolizin-3-yl)ethanoyl]amino]ethyl 4-nitrobenzoate Openeye Name: 2-[[2-oxo-2-(2-phenylindolizin-3-yl)acetyl]amino]ethyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-[[1,2-dioxo-2-(2-phenyl-3-indolizinyl)ethyl]amino]ethyl ester IUPAC Name: 2-[[2-oxo-2-(2-phenylindolizin-3-yl)acetyl]amino]ethyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2-[[2-keto-2-(2-phenylindolizin-3-yl)acetyl]amino]ethyl ester Formula: C25H19N3O6 MolecularWeight: 457.43486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N3C=CC=CC3=C2)C(=O)C(=O)NCCOC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N3C=CC=CC3=C2)C(=O)C(=O)NCCOC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H19N3O6/c29-23(22-21(17-6-2-1-3-7-17)16-20-8-4-5-14-27(20)22)24(30)26-13-15-34-25(31)18-9-11-19(12-10-18)28(32)33/h1-12,14,16H,13,15H2,(H,26,30)