N-[3-chloranyl-4-(4-methylpiperazin-1-yl)phenyl]-4-ethoxy-3-nitro-benzamide

Systemtic Name: N-[3-chloranyl-4-(4-methylpiperazin-1-yl)phenyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[3-chloro-4-(4-methyl-1-piperazinyl)phenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[3-chloro-4-(4-methylpiperazino)phenyl]-4-ethoxy-3-nitro-benzamide Formula: C20H23ClN4O4 MolecularWeight: 418.87402

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C)Cl)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)N3CCN(CC3)C)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H23ClN4O4/c1-3-29-19-7-4-14(12-18(19)25(27)28)20(26)22-15-5-6-17(16(21)13-15)24-10-8-23(2)9-11-24/h4-7,12-13H,3,8-11H2,1-2H3,(H,22,26)