N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-methyl-4-nitro-benzamide

Systemtic Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-methyl-4-nitro-benzamide Openeye Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-methyl-4-nitro-benzamide CAS Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-methyl-4-nitrobenzamide IUPAC Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methylphenyl]-3-methyl-4-nitrobenzamide Traditional Name: N-[3-(5,7-dimethyl-1,3-benzoxazol-2-yl)-2-methyl-phenyl]-3-methyl-4-nitro-benzamide Formula: C24H21N3O4 MolecularWeight: 415.44124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CC=C3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])C)C)C

Isomeric SMILES

CC1=CC(=C2C(=C1)N=C(O2)C3=C(C(=CC=C3)NC(=O)C4=CC(=C(C=C4)[N+](=O)[O-])C)C)C

InChI

InChI=1S/C24H21N3O4/c1-13-10-15(3)22-20(11-13)26-24(31-22)18-6-5-7-19(16(18)4)25-23(28)17-8-9-21(27(29)30)14(2)12-17/h5-12H,1-4H3,(H,25,28)