N-(4-chloranyl-2-nitro-phenyl)-2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]ethanamide

Systemtic Name: N-(4-chloranyl-2-nitro-phenyl)-2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]ethanamide Openeye Name: N-(4-chloro-2-nitro-phenyl)-2-[4-(2,3-dihydrobenzofuran-5-ylmethyl)piperazin-1-yl]acetamide CAS Name: N-(4-chloro-2-nitrophenyl)-2-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-1-piperazinyl]acetamide IUPAC Name: N-(4-chloro-2-nitrophenyl)-2-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)piperazin-1-yl]acetamide Traditional Name: N-(4-chloro-2-nitro-phenyl)-2-[4-(coumaran-5-ylmethyl)piperazino]acetamide Formula: C21H23ClN4O4 MolecularWeight: 430.88472

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CN3CCN(CC3)CC(=O)NC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COC2=C1C=C(C=C2)CN3CCN(CC3)CC(=O)NC4=C(C=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C21H23ClN4O4/c22-17-2-3-18(19(12-17)26(28)29)23-21(27)14-25-8-6-24(7-9-25)13-15-1-4-20-16(11-15)5-10-30-20/h1-4,11-12H,5-10,13-14H2,(H,23,27)