ethyl 4-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]benzoate Openeye Name: ethyl 4-[[3-nitro-4-(1-piperidyl)benzoyl]amino]benzoate CAS Name: 4-[[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3-nitro-4-piperidin-1-ylbenzoyl)amino]benzoate Traditional Name: 4-[(3-nitro-4-piperidino-benzoyl)amino]benzoic acid ethyl ester Formula: C21H23N3O5 MolecularWeight: 397.42442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O5/c1-2-29-21(26)15-6-9-17(10-7-15)22-20(25)16-8-11-18(19(14-16)24(27)28)23-12-4-3-5-13-23/h6-11,14H,2-5,12-13H2,1H3,(H,22,25)