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

Systemtic Name: N-[2-(5-chloranyl-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide Openeye Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide CAS Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-(4-methyl-1-piperazinyl)-3-nitrobenzamide IUPAC Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperazin-1-yl)-3-nitrobenzamide Traditional Name: N-[2-(5-chloro-1,3-benzoxazol-2-yl)phenyl]-4-(4-methylpiperazino)-3-nitro-benzamide Formula: C25H22ClN5O4 MolecularWeight: 491.92628

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C4=NC5=C(O4)C=CC(=C5)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=CC=C3C4=NC5=C(O4)C=CC(=C5)Cl)[N+](=O)[O-]

InChI

InChI=1S/C25H22ClN5O4/c1-29-10-12-30(13-11-29)21-8-6-16(14-22(21)31(33)34)24(32)27-19-5-3-2-4-18(19)25-28-20-15-17(26)7-9-23(20)35-25/h2-9,14-15H,10-13H2,1H3,(H,27,32)