N-[(E)-[3-methyl-2-(4-methylpiperazin-1-yl)carbonyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-4-nitro-benzamide

Systemtic Name: N-[(E)-[3-methyl-2-(4-methylpiperazin-1-yl)carbonyl-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-4-nitro-benzamide Openeye Name: N-[(E)-[3-methyl-2-(4-methylpiperazine-1-carbonyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-4-nitro-benzamide CAS Name: N-[(E)-[3-methyl-2-[(4-methyl-1-piperazinyl)-oxomethyl]-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-4-nitrobenzamide IUPAC Name: N-[(E)-[3-methyl-2-(4-methylpiperazine-1-carbonyl)-6,7-dihydro-5H-1-benzofuran-4-ylidene]amino]-4-nitrobenzamide Traditional Name: N-[(E)-[3-methyl-2-(4-methylpiperazine-1-carbonyl)-6,7-dihydro-5H-benzofuran-4-ylidene]amino]-4-nitro-benzamide Formula: C22H25N5O5 MolecularWeight: 439.4644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])CCC2)C(=O)N4CCN(CC4)C

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])/CCC2)C(=O)N4CCN(CC4)C

InChI

InChI=1S/C22H25N5O5/c1-14-19-17(23-24-21(28)15-6-8-16(9-7-15)27(30)31)4-3-5-18(19)32-20(14)22(29)26-12-10-25(2)11-13-26/h6-9H,3-5,10-13H2,1-2H3,(H,24,28)/b23-17+