N-[5-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-2-methyl-3-nitro-benzamide

Systemtic Name: N-[5-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-2-methyl-3-nitro-benzamide Openeye Name: N-[5-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-2-methyl-3-nitro-benzamide CAS Name: N-[5-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-methyl-3-nitrobenzamide IUPAC Name: N-[5-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methoxyphenyl]-2-methyl-3-nitrobenzamide Traditional Name: N-[5-(5,6-dimethyl-1,3-benzoxazol-2-yl)-2-methoxy-phenyl]-2-methyl-3-nitro-benzamide Formula: C24H21N3O5 MolecularWeight: 431.44064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)OC(=N2)C3=CC(=C(C=C3)OC)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC2=C(C=C1C)OC(=N2)C3=CC(=C(C=C3)OC)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C24H21N3O5/c1-13-10-18-22(11-14(13)2)32-24(26-18)16-8-9-21(31-4)19(12-16)25-23(28)17-6-5-7-20(15(17)3)27(29)30/h5-12H,1-4H3,(H,25,28)