N-[4-chloranyl-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[4-chloranyl-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[4-chloro-3-(6-methyl-1,3-benzoxazol-2-yl)phenyl]-4-methoxy-3-nitro-benzamide Formula: C22H16ClN3O5 MolecularWeight: 437.83254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)C4=CC(=C(C=C4)OC)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3=C(C=CC(=C3)NC(=O)C4=CC(=C(C=C4)OC)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H16ClN3O5/c1-12-3-7-17-20(9-12)31-22(25-17)15-11-14(5-6-16(15)23)24-21(27)13-4-8-19(30-2)18(10-13)26(28)29/h3-11H,1-2H3,(H,24,27)