5-acetamido-2-nitro-N-[4-[4-(5-phenyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]benzamide

Systemtic Name: 5-acetamido-2-nitro-N-[4-[4-(5-phenyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]benzamide Openeye Name: 5-acetamido-2-nitro-N-[4-[4-(5-phenyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]benzamide CAS Name: 5-acetamido-2-nitro-N-[4-[4-(5-phenyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]benzamide IUPAC Name: 5-acetamido-2-nitro-N-[4-[4-(5-phenyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]benzamide Traditional Name: 5-acetamido-2-nitro-N-[4-[4-(5-phenyl-1,3-benzoxazol-2-yl)-1H-pyrazol-5-yl]phenyl]benzamide Formula: C31H22N6O5 MolecularWeight: 558.54358

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)C3=C(C=NN3)C4=NC5=C(O4)C=CC(=C5)C6=CC=CC=C6

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)C3=C(C=NN3)C4=NC5=C(O4)C=CC(=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H22N6O5/c1-18(38)33-23-12-13-27(37(40)41)24(16-23)30(39)34-22-10-7-20(8-11-22)29-25(17-32-36-29)31-35-26-15-21(9-14-28(26)42-31)19-5-3-2-4-6-19/h2-17H,1H3,(H,32,36)(H,33,38)(H,34,39)