4-methoxy-N-[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide

Systemtic Name: 4-methoxy-N-[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide Openeye Name: 4-methoxy-N-[2-(m-tolyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide CAS Name: 4-methoxy-N-[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide IUPAC Name: 4-methoxy-N-[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide Traditional Name: 4-methoxy-N-[2-(m-tolyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide Formula: C22H17N3O5 MolecularWeight: 403.38748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC(=C(C=C4)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC(=C(C=C4)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O5/c1-13-4-3-5-15(10-13)22-24-17-12-16(7-9-19(17)30-22)23-21(26)14-6-8-20(29-2)18(11-14)25(27)28/h3-12H,1-2H3,(H,23,26)