N-[1-benzofuran-2-yl(phenyl)methyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[1-benzofuran-2-yl(phenyl)methyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide Openeye Name: N-[benzofuran-2-yl(phenyl)methyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide CAS Name: N-[2-benzofuranyl(phenyl)methyl]-4-(4-methyl-1-piperazinyl)-3-nitrobenzamide IUPAC Name: N-[1-benzofuran-2-yl(phenyl)methyl]-4-(4-methylpiperazin-1-yl)-3-nitrobenzamide Traditional Name: N-[benzofuran-2-yl(phenyl)methyl]-4-(4-methylpiperazino)-3-nitro-benzamide Formula: C27H26N4O4 MolecularWeight: 470.51974

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(C3=CC=CC=C3)C4=CC5=CC=CC=C5O4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(C3=CC=CC=C3)C4=CC5=CC=CC=C5O4)[N+](=O)[O-]

InChI

InChI=1S/C27H26N4O4/c1-29-13-15-30(16-14-29)22-12-11-21(17-23(22)31(33)34)27(32)28-26(19-7-3-2-4-8-19)25-18-20-9-5-6-10-24(20)35-25/h2-12,17-18,26H,13-16H2,1H3,(H,28,32)