2-dimethylaminoethyl 4-[[5-(4-nitrophenyl)furan-2-yl]carbonylamino]benzoate

Systemtic Name: 2-dimethylaminoethyl 4-[[5-(4-nitrophenyl)furan-2-yl]carbonylamino]benzoate Openeye Name: 2-dimethylaminoethyl 4-[[5-(4-nitrophenyl)furan-2-carbonyl]amino]benzoate CAS Name: 4-[[[5-(4-nitrophenyl)-2-furanyl]-oxomethyl]amino]benzoic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 4-[[5-(4-nitrophenyl)furan-2-carbonyl]amino]benzoate Traditional Name: 4-[[5-(4-nitrophenyl)-2-furoyl]amino]benzoic acid 2-dimethylaminoethyl ester Formula: C22H21N3O6 MolecularWeight: 423.41864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O6/c1-24(2)13-14-30-22(27)16-3-7-17(8-4-16)23-21(26)20-12-11-19(31-20)15-5-9-18(10-6-15)25(28)29/h3-12H,13-14H2,1-2H3,(H,23,26)