N-[5-[5-[(2R)-butan-2-yl]-1,3-benzoxazol-2-yl]-2-chloranyl-phenyl]-4-ethoxy-3-nitro-benzamide

Systemtic Name: N-[5-[5-[(2R)-butan-2-yl]-1,3-benzoxazol-2-yl]-2-chloranyl-phenyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[2-chloro-5-[5-[(1R)-1-methylpropyl]-1,3-benzoxazol-2-yl]phenyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[5-[5-[(2R)-butan-2-yl]-1,3-benzoxazol-2-yl]-2-chlorophenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[5-[5-[(2R)-butan-2-yl]-1,3-benzoxazol-2-yl]-2-chlorophenyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[2-chloro-5-[5-[(1R)-1-methylpropyl]-1,3-benzoxazol-2-yl]phenyl]-4-ethoxy-3-nitro-benzamide Formula: C26H24ClN3O5 MolecularWeight: 493.93886

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC(=C(C=C4)OCC)[N+](=O)[O-]

Isomeric SMILES

CC[C@@H](C)C1=CC2=C(C=C1)OC(=N2)C3=CC(=C(C=C3)Cl)NC(=O)C4=CC(=C(C=C4)OCC)[N+](=O)[O-]

InChI

InChI=1S/C26H24ClN3O5/c1-4-15(3)16-7-10-23-21(12-16)29-26(35-23)18-6-9-19(27)20(13-18)28-25(31)17-8-11-24(34-5-2)22(14-17)30(32)33/h6-15H,4-5H2,1-3H3,(H,28,31)/t15-/m1/s1