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

Systemtic Name: butyl 4-[(3-nitro-4-piperidin-1-yl-phenyl)carbonylamino]benzoate Openeye Name: butyl 4-[[3-nitro-4-(1-piperidyl)benzoyl]amino]benzoate CAS Name: 4-[[[3-nitro-4-(1-piperidinyl)phenyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[(3-nitro-4-piperidin-1-ylbenzoyl)amino]benzoate Traditional Name: 4-[(3-nitro-4-piperidino-benzoyl)amino]benzoic acid butyl ester Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O5/c1-2-3-15-31-23(28)17-7-10-19(11-8-17)24-22(27)18-9-12-20(21(16-18)26(29)30)25-13-5-4-6-14-25/h7-12,16H,2-6,13-15H2,1H3,(H,24,27)