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

Systemtic Name: 2-chloranyl-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-4-nitro-benzamide Openeye Name: 2-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-4-nitro-benzamide CAS Name: 2-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-4-nitrobenzamide IUPAC Name: 2-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-4-nitrobenzamide Traditional Name: 2-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-4-nitro-benzamide Formula: C24H21ClN4O4 MolecularWeight: 464.90094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H21ClN4O4/c1-3-28(4-2)17-8-5-15(6-9-17)24-27-21-13-16(7-12-22(21)33-24)26-23(30)19-11-10-18(29(31)32)14-20(19)25/h5-14H,3-4H2,1-2H3,(H,26,30)